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20698-30-0

20698-30-0 | Cyclohexanol, 4-(1,1-dimethylpropyl)-, trans-

CAS No: 20698-30-0 Catalog No: AG002IRF MDL No:

Product Description

Catalog Number:
AG002IRF
Chemical Name:
Cyclohexanol, 4-(1,1-dimethylpropyl)-, trans-
CAS Number:
20698-30-0
Molecular Formula:
C11H22O
Molecular Weight:
170.2918
IUPAC Name:
4-(2-methylbutan-2-yl)cyclohexan-1-ol
InChI:
InChI=1S/C11H22O/c1-4-11(2,3)9-5-7-10(12)8-6-9/h9-10,12H,4-8H2,1-3H3
InChI Key:
VDQZABQVXYELSI-UHFFFAOYSA-N
SMILES:
CCC([C@@H]1CC[C@H](CC1)O)(C)C
UNII:
X0DQ676P08

Properties

Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.167g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.296g/mol
Monoisotopic Mass:
170.167g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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