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Structure

1-Cyano-2-methyl-3-(3-methylphenyl)isothiourea

CAS
21504-97-2
Catalog Number
ACM21504972
Category
Other Products
Molecular Weight
205.28
Molecular Formula
C10H11N3S

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Specification

Synonyms
1-CYANO-2-METHYL-3-(3-METHYLPHENYL)ISOTHIOUREA
IUPAC Name
methyl N-cyano-N-(3-methylphenyl)carbamimidothioate
Canonical SMILES
CC1=CC(=CC=C1)N=C(NC#N)SC
InChI Key
XUODJDOHCUSZJY-UHFFFAOYSA-N
Boiling Point
337.9ºC at 760mmHg
Flash Point
158.2ºC
Density
1.11g/cm³
Exact Mass
205.06700
H-Bond Acceptor
3
H-Bond Donor
1
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