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1562-25-0 | Phenol, 4-(1-methylcyclopentyl)-
CAS No: 1562-25-0 Catalog No: AG001OKR MDL No:
Product Description
Catalog Number:
AG001OKR
Chemical Name:
Phenol, 4-(1-methylcyclopentyl)-
CAS Number:
1562-25-0
Molecular Formula:
C12H16O
Molecular Weight:
176.2548
IUPAC Name:
4-(1-methylcyclopentyl)phenol
InChI:
InChI=1S/C12H16O/c1-12(8-2-3-9-12)10-4-6-11(13)7-5-10/h4-7,13H,2-3,8-9H2,1H3
InChI Key:
XQDKIMZRWNYNOI-UHFFFAOYSA-N
SMILES:
CC1(CCCC1)c1ccc(cc1)O
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.12g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.259g/mol
Monoisotopic Mass:
176.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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