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In-can and dry-film biocides

YM 13115

CAS 92071-93-7Formula C21H17N6Na3O10S4Molar mass 710.64 g/mol
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YM 13115 chemical structure, C21H17N6Na3O10S4, CAS 92071-93-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
92071-93-7
Formula
C21H17N6Na3O10S4
Molar mass
710.64 g/mol
HS code
294190
Category
In-can and dry-film biocides

What is YM 13115?

Plain description, key identifiers and synonyms

YM 13115 is a chemical substance with the molecular formula C21H17N6Na3O10S4 and a molar mass of 710.64 g/mol. Its CAS registry number is 92071-93-7. The IUPAC name is trisodium, (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxylatopropan-2-yloxyimino)acetyl]amino]-3-[(4-carboxylato-3-oxo-1,2-thiazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
trisodium, (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxylatopropan-2-yloxyimino)acetyl]amino]-3-[(4-carboxylato-3-oxo-1,2-thiazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS number
92071-93-7
Molecular formula
C21H17N6Na3O10S4
UNII
97ROW4597G
InChIKey
CSTWJIMFWZQABL-HNVVXWNDSA-K
InChI
InChI=1S/C21H20N6O10S4.3Na/c1-21(2,19(35)36)37-25-9(7-5-40-20(22)23-7)13(29)24-10-14(30)27-11(17(33)34)6(3-38-15(10)27)4-39-18-8(16(31)32)12(28)26-41-18;;;/h5,10,15H,3-4H2,1-2H3,(H2,22,23)(H,24,29)(H,26,28)(H,31,32)(H,33,34)(H,35,36);;;/q;3*+1/p-3/b25-9-;;;/t10-,15-;;;/m1.../s1
Canonical SMILES
CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(CSc3s[nH]c(=O)c3C(=O)[O-])CSC12)c1csc(N)n1)C(=O)[O-].[Na+].[Na+].[Na+]
Isomeric SMILES
CC(C)(C(=O)[O-])O/N=C(/C1=CSC(=N1)N)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CSC4=C(C(=O)NS4)C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]

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
710.64 g/molcalc.
Exact mass
709.9582 Dacalc.
LogP (octanol/water)
-12.7calc.
Topological polar surface area
263.2 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
17calc.
Rotatable bonds
11calc.
Heavy atoms
44calc.
Rings
4calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.33calc.
Formal charge
0calc.
Stereocentres
2calc.
Components
4calc.
Lipinski rule of five
Fails (2 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, N=C(C(=O)NC1C(=O)N2C=C(CSc3cc(=O)[nH]s3)CSC12)c1cscn1

N=C(C(=O)NC1C(=O)N2C=C(CSc3cc(=O)[nH]s3)CSC12)c1cscn1

4 rings, 27 atoms.

1 other chemical 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.

YM 13115 suppliers

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YM 13115 price

Indicative price range per kg from live supplier offers

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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 YM 13115 is traded under.

HS 2941.90Indicative HS code

Antibiotics, other

World exports in 2024
$6.39B
+2.3% vs 2023, imports $6.97B
2019 to 2024
Top exporters
  1. China39.7%
  2. United States11.3%
  3. Switzerland * partner reported10.9%
Top importers
  1. Italy15.0%
  2. India * partner reported12.0%
  3. China8.7%

* Partner reported figures, a lower bound.

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

The HS code shown for YM 13115 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about YM 13115, based on the data on this page

What is YM 13115?

YM 13115 is a chemical substance with the molecular formula C21H17N6Na3O10S4 and a molar mass of 710.64 g/mol. Its CAS registry number is 92071-93-7.

What is the CAS number of YM 13115?

The CAS registry number of YM 13115 is 92071-93-7.

What is the molecular formula and weight of YM 13115?

The molecular formula of YM 13115 is C21H17N6Na3O10S4 and its molar mass is 710.64 g/mol.

What is YM 13115 used for?

Known uses and roles of YM 13115 include biocides in paints and coatings and preservatives in home care and cleaning.

Is YM 13115 hazardous?

No GHS hazard classification for YM 13115 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 YM 13115?

YM 13115 is usually classified under HS code 294190 (Antibiotics, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy YM 13115?

Post a free request on CompoundList and suppliers of YM 13115 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of YM 13115?

Suppliers quote YM 13115 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 YM 13115

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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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