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1249753-35-2 | Cyclopentyl (2-bromophenyl)methanol
CAS No: 1249753-35-2 Catalog No: AG01FDUI MDL No:
Product Description
Catalog Number:
AG01FDUI
Chemical Name:
Cyclopentyl (2-bromophenyl)methanol
CAS Number:
1249753-35-2
Molecular Formula:
C12H15BrO
Molecular Weight:
255.1509
IUPAC Name:
(2-bromophenyl)-cyclopentylmethanol
InChI:
InChI=1S/C12H15BrO/c13-11-8-4-3-7-10(11)12(14)9-5-1-2-6-9/h3-4,7-9,12,14H,1-2,5-6H2
InChI Key:
KNJBVYDOFBWHQP-UHFFFAOYSA-N
SMILES:
OC(c1ccccc1Br)C1CCCC1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.031g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.155g/mol
Monoisotopic Mass:
254.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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