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90407-14-0

90407-14-0 | 7-Chlorobenzo[b]thiophene

CAS No: 90407-14-0 Catalog No: AG0038JP MDL No:MFCD00130097

Product Description

Catalog Number:
AG0038JP
Chemical Name:
7-Chlorobenzo[b]thiophene
CAS Number:
90407-14-0
Molecular Formula:
C8H5ClS
Molecular Weight:
168.6433
MDL Number:
MFCD00130097
IUPAC Name:
7-chloro-1-benzothiophene
InChI:
InChI=1S/C8H5ClS/c9-7-3-1-2-6-4-5-10-8(6)7/h1-5H
InChI Key:
GKWIITWUDNYXMG-UHFFFAOYSA-N
SMILES:
Clc1cccc2c1scc2

Properties

Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.98g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.638g/mol
Monoisotopic Mass:
167.98g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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