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805750

Sigma-Aldrich

Captan-3,3,4,5,6,6-d6

98 atom % D, 98% (CP)

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About This Item

Empirical Formula (Hill Notation):
C9D6H2Cl3NO2S
CAS Number:
1330190-00-5
Molecular Weight:
306.63
MDL number:
MFCD22565734
UNSPSC Code:
12352116
PubChem Substance ID:
329768958
NACRES:
NA.12

isotopic purity

98 atom % D

Quality Level

200

Assay

98% (CP)

form

powder

technique(s)

mass spectrometry (MS): suitable

mass shift

M+6

SMILES string

[2H]C1([2H])C2C(C(N(SC(Cl)(Cl)Cl)C2=O)=O)C([2H])([2H])C([2H])=C1[2H]

InChI

1S/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2/i1D,2D,3D2,4D2

InChI key

LDVVMCZRFWMZSG-TZCZJOIZSA-N

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Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Signal Word

Danger

Hazard Statements

H317,H318,H331,H351,H410

Hazard Classifications

Acute Tox. 3 Inhalation - Aquatic Acute 1 - Aquatic Chronic 1 - Carc. 2 - Eye Dam. 1 - Skin Sens. 1

Storage Class Code

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
MBBD7220
MBBD3820
MBBD1761
MBBD1533
MBBD0817

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