NAVIGATION


Thianaphthene

Catalog Number
ACM95158
CAS Number
95-15-8
Product Name
Thianaphthene
Structure
Category
Other Electronic Materials
IUPAC Name
1-benzothiophene
Molecular Weight
134.2g/mol
Molecular Formula
C8H6S
Canonical SMILES
C1=CC=C2C(=C1)C=CS2
InChI
InChI=1S/C8H6S/c1-2-4-8-7(3-1)5-6-9-8/h1-6H
InChI Key
FCEHBMOGCRZNNI-UHFFFAOYSA-N
Boiling Point
221.0 °C
Melting Point
32.0 °C
Flash Point
62°C
Density
1.187 g/cm³ at 25 °C(lit.)
Solubility
9.69e-04 M
Complexity
101
Covalently-Bonded Unit Count
1
EC Number
202-395-7
Exact Mass
134.019021g/mol
Formal Charge
0
Heavy Atom Count
9
Log P
3.12 (LogP)
MeSH Entry Terms
benzo(b)thiophene;benzothiophene;thianaphthene
Monoisotopic Mass
134.019021g/mol
NSC Number
47196
Rotatable Bond Count
0
UNII
073790YQ2G
Vapor Pressure
0.24 mmHg
XLogP3
3.1
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