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1249680-53-2 | Cycloheptyl (4-chlorophenyl)methanol
CAS No: 1249680-53-2 Catalog No: AG01FDGD MDL No:
Product Description
Catalog Number:
AG01FDGD
Chemical Name:
Cycloheptyl (4-chlorophenyl)methanol
CAS Number:
1249680-53-2
Molecular Formula:
C14H19ClO
Molecular Weight:
238.7531
IUPAC Name:
(4-chlorophenyl)-cycloheptylmethanol
InChI:
InChI=1S/C14H19ClO/c15-13-9-7-12(8-10-13)14(16)11-5-3-1-2-4-6-11/h7-11,14,16H,1-6H2
InChI Key:
CGMDSXAOEJXCEE-UHFFFAOYSA-N
SMILES:
OC(c1ccc(cc1)Cl)C1CCCCCC1
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.112g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.755g/mol
Monoisotopic Mass:
238.112g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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