Benzo[b]thiophene, 3-methyl-


Chemical Name: Benzo[b]thiophene, 3-methyl-
CAS Number: 1455-18-1
Product Number: AG001D4G(AGN-PC-0JLB7M)
Synonyms:
MDL No:
Molecular Formula: C9H8S
Molecular Weight: 148.2248

Identification/Properties


Properties
MP:
-40°C
BP:
72-74°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.6240(lit.)
Computed Properties
Molecular Weight:
148.223g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
148.035g/mol
Monoisotopic Mass:
148.035g/mol
Topological Polar Surface Area:
28.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
122
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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