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Home > Bromides > 1171926-64-9
1171926-64-9 | Benzo[b]thiophene-2-methanol, 7-bromo-
CAS No: 1171926-64-9 Catalog No: AG000DVS MDL No:MFCD12032282
Product Description
Catalog Number:
AG000DVS
Chemical Name:
Benzo[b]thiophene-2-methanol, 7-bromo-
CAS Number:
1171926-64-9
Molecular Formula:
C9H7BrOS
Molecular Weight:
243.1203
MDL Number:
MFCD12032282
IUPAC Name:
(7-bromo-1-benzothiophen-2-yl)methanol
InChI:
InChI=1S/C9H7BrOS/c10-8-3-1-2-6-4-7(5-11)12-9(6)8/h1-4,11H,5H2
InChI Key:
GOQLHIBVKJDKPR-UHFFFAOYSA-N
SMILES:
OCc1cc2c(s1)c(Br)ccc2
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.94g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.118g/mol
Monoisotopic Mass:
241.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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