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1443324-25-1 | Cycloheptyl (3-bromophenyl)methanol
CAS No: 1443324-25-1 Catalog No: AG01FDXI MDL No:
Product Description
Catalog Number:
AG01FDXI
Chemical Name:
Cycloheptyl (3-bromophenyl)methanol
CAS Number:
1443324-25-1
Molecular Formula:
C14H19BrO
Molecular Weight:
283.2041
IUPAC Name:
(3-bromophenyl)-cycloheptylmethanol
InChI:
InChI=1S/C14H19BrO/c15-13-9-5-8-12(10-13)14(16)11-6-3-1-2-4-7-11/h5,8-11,14,16H,1-4,6-7H2
InChI Key:
QCNBAWOLJFQULW-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C(C1CCCCCC1)O
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.062g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.209g/mol
Monoisotopic Mass:
282.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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