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142181-53-1

142181-53-1 | Benzo[b]thiophene-3-methanol, 7-chloro-

CAS No: 142181-53-1 Catalog No: AG001HWV MDL No:MFCD28164085

Product Description

Catalog Number:
AG001HWV
Chemical Name:
Benzo[b]thiophene-3-methanol, 7-chloro-
CAS Number:
142181-53-1
Molecular Formula:
C9H7ClOS
Molecular Weight:
198.6693
MDL Number:
MFCD28164085
IUPAC Name:
(7-chloro-1-benzothiophen-3-yl)methanol
InChI:
InChI=1S/C9H7ClOS/c10-8-3-1-2-7-6(4-11)5-12-9(7)8/h1-3,5,11H,4H2
InChI Key:
TZFBEHOZYXSGHL-UHFFFAOYSA-N
SMILES:
OCc1csc2c1cccc2Cl
UNII:
9V3I2RS6WC

Properties

Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.991g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.664g/mol
Monoisotopic Mass:
197.991g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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