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17964-88-4 | 3-Bromo-2-thienyl-(3-thienyl)methanol
CAS No: 17964-88-4 Catalog No: AG01FD8L MDL No:
Product Description
Catalog Number:
AG01FD8L
Chemical Name:
3-Bromo-2-thienyl-(3-thienyl)methanol
CAS Number:
17964-88-4
Molecular Formula:
C9H7BrOS2
Molecular Weight:
275.1853
IUPAC Name:
(3-bromothiophen-2-yl)-thiophen-3-ylmethanol
InChI:
InChI=1S/C9H7BrOS2/c10-7-2-4-13-9(7)8(11)6-1-3-12-5-6/h1-5,8,11H
InChI Key:
VSRNBUJQMCRURT-UHFFFAOYSA-N
SMILES:
Brc1ccsc1C(c1cscc1)O
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.912g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.178g/mol
Monoisotopic Mass:
273.912g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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