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Aliphatic and alicyclic building blocks

Dde-D-dab(alloc)-OH

Also known as (R)-4-(((Allyloxy)carbonyl)amino)-2-((1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl)amino)butanoic acid, (2R)-4-(allyloxycarbonylamino)-2-[1-(4,4-dimethyl-2,6-dioxo-cyclohexylidene)ethylamino]butanoic acid, (R)-N-alpha-(4,4-Dimethyl-2,6-dioxocyclohex-1-ylidene)ethyl-N-gamma-allyloxycarbonyl-D-2,4-diaminobutyric acid (Dde-D-Dab(Alloc)-OH)

CAS 1263046-79-2Formula C18H26N2O6Molar mass 366.41 g/mol
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Dde-D-dab(alloc)-OH chemical structure, C18H26N2O6, CAS 1263046-79-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1263046-79-2
Formula
C18H26N2O6
Molar mass
366.41 g/mol
HS code
292529
Category
Aliphatic and alicyclic building blocks

What is Dde-D-dab(alloc)-OH?

Plain description, key identifiers and synonyms

Dde-D-dab(alloc)-OH is a chemical substance with the molecular formula C18H26N2O6 and a molar mass of 366.41 g/mol. Its CAS registry number is 1263046-79-2. The IUPAC name is (2R)-2-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)ethylideneamino]-4-(prop-2-enoxycarbonylamino)butanoic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2R)-2-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)ethylideneamino]-4-(prop-2-enoxycarbonylamino)butanoic acid
CAS number
1263046-79-2
Molecular formula
C18H26N2O6
MDL number
MFCD05663736
InChIKey
BJSDGSZSUXSVKJ-GFCCVEGCSA-N
InChI
InChI=1S/C18H26N2O6/c1-5-8-26-17(25)19-7-6-12(16(23)24)20-11(2)15-13(21)9-18(3,4)10-14(15)22/h5,12,21H,1,6-10H2,2-4H3,(H,19,25)(H,23,24)/t12-/m1/s1
Canonical SMILES
C=CCOC(=O)NCCC(N=C(C)C1=C(O)CC(C)(C)CC1=O)C(=O)O
Isomeric SMILES
CC(=N[C@H](CCNC(=O)OCC=C)C(=O)O)C1=C(CC(CC1=O)(C)C)O

Synonyms

  • (R)-4-(((Allyloxy)carbonyl)amino)-2-((1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl)amino)butanoic acid
  • (2R)-4-(allyloxycarbonylamino)-2-[1-(4,4-dimethyl-2,6-dioxo-cyclohexylidene)ethylamino]butanoic acid
  • (R)-N-alpha-(4,4-Dimethyl-2,6-dioxocyclohex-1-ylidene)ethyl-N-gamma-allyloxycarbonyl-D-2,4-diaminobutyric acid (Dde-D-Dab(Alloc)-OH)

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
366.41 g/molcalc.
Exact mass
366.1791 Dacalc.
LogP (octanol/water)
2.4calc.
Topological polar surface area
125.3 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
8calc.
Heavy atoms
26calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.56calc.
Formal charge
0calc.
Stereocentres
1calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1C=CCCC1

O=C1C=CCCC1

1 ring, 7 atoms, the 2-Cyclohexen-1-one ring system.

1,362 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Dde-D-dab(alloc)-OH suppliers

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Dde-D-dab(alloc)-OH price

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Dde-D-dab(alloc)-OH is traded under.

HS 2925.29Indicative HS code

Imines and their derivatives, salts thereof, other

World exports in 2024
$1.8B
+12.4% vs 2023, imports $1.84B
2019 to 2024
Top exporters
  1. China35.9%
  2. France * partner reported15.5%
  3. Germany9.1%
Top importers
  1. United States13.3%
  2. China13.0%
  3. Brazil9.7%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Dde-D-dab(alloc)-OH is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Dde-D-dab(alloc)-OH, based on the data on this page

What is Dde-D-dab(alloc)-OH?

Dde-D-dab(alloc)-OH is a chemical substance with the molecular formula C18H26N2O6 and a molar mass of 366.41 g/mol. Its CAS registry number is 1263046-79-2. The IUPAC name is (2R)-2-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)ethylideneamino]-4-(prop-2-enoxycarbonylamino)butanoic acid.

What is the CAS number of Dde-D-dab(alloc)-OH?

The CAS registry number of Dde-D-dab(alloc)-OH is 1263046-79-2.

What is the molecular formula and weight of Dde-D-dab(alloc)-OH?

The molecular formula of Dde-D-dab(alloc)-OH is C18H26N2O6 and its molar mass is 366.41 g/mol.

What is Dde-D-dab(alloc)-OH used for?

Known uses and roles of Dde-D-dab(alloc)-OH include building blocks in research and laboratory.

Is Dde-D-dab(alloc)-OH hazardous?

No GHS hazard classification for Dde-D-dab(alloc)-OH is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Dde-D-dab(alloc)-OH?

Dde-D-dab(alloc)-OH is usually classified under HS code 292529 (Imines and their derivatives, salts thereof, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Dde-D-dab(alloc)-OH?

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What is the price of Dde-D-dab(alloc)-OH?

Suppliers quote Dde-D-dab(alloc)-OH on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Dde-D-dab(alloc)-OH

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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