5-Chloro-3-methylbenzo[b]thiophene
Catalog Number
ACM19404183
CAS
19404-18-3
IUPAC Name
5-chloro-3-methyl-1-benzothiophene
Synonyms
5-Chloro-3-methylthianaphthene; 5-chloro-3-methyl-1-benzothiophene
Molecular Weight
182.67
Molecular Formula
C9H7ClS
Product Information
Canonical SMILES
CC1=CSC2=C1C=C(C=C2)Cl
InChI
InChI=1S/C9H7ClS/c1-6-5-11-9-3-2-7(10)4-8(6)9/h2-5H,1H3
InChI Key
UWDQVEPXORTQFO-UHFFFAOYSA-N
Boiling Point
144 °C/14 mmHg
Melting Point
35 °C
Flash Point
163.1°C
Purity
>98.0%(GC)
Density
1.293 g/cm³ at 25 °C(lit.)
Appearance
White to Yellow to Orange powder to lump
Complexity
149
Exact Mass
181.995699g/mol
Heavy Atom Count
11
MDL Number
MFCD00052506
Monoisotopic Mass
181.995699g/mol
Reaxys Registry Number
1282502
Rotatable Bond Count
0
Please kindly note that our products and services are for research use only.
Have a question? Get a Free Consultation