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70197-54-5

70197-54-5 | 4,4-dimethylcyclopentane-1,2-diol

CAS No: 70197-54-5 Catalog No: AG005KPS MDL No:MFCD10568550

Product Description

Catalog Number:
AG005KPS
Chemical Name:
4,4-dimethylcyclopentane-1,2-diol
CAS Number:
70197-54-5
Molecular Formula:
C7H14O2
Molecular Weight:
130.1849
MDL Number:
MFCD10568550
IUPAC Name:
4,4-dimethylcyclopentane-1,2-diol
InChI:
InChI=1S/C7H14O2/c1-7(2)3-5(8)6(9)4-7/h5-6,8-9H,3-4H2,1-2H3
InChI Key:
KGUCQDAECKHULR-UHFFFAOYSA-N
SMILES:
OC1CC(CC1O)(C)C
NSC Number:
131030

Properties

Complexity:
97.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.099g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
130.187g/mol
Monoisotopic Mass:
130.099g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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