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102369-67-5 | Cyclohexanemethanol, 3,3-dimethyl-
CAS No: 102369-67-5 Catalog No: AG0007AE MDL No:MFCD21324307
Product Description
Catalog Number:
AG0007AE
Chemical Name:
Cyclohexanemethanol, 3,3-dimethyl-
CAS Number:
102369-67-5
Molecular Formula:
C9H18O
Molecular Weight:
142.2386
MDL Number:
MFCD21324307
IUPAC Name:
(3,3-dimethylcyclohexyl)methanol
InChI:
InChI=1S/C9H18O/c1-9(2)5-3-4-8(6-9)7-10/h8,10H,3-7H2,1-2H3
InChI Key:
VJZDBRGSBDTGKQ-UHFFFAOYSA-N
SMILES:
OCC1CCCC(C1)(C)C
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
142.242g/mol
Monoisotopic Mass:
142.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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