Home Other Building Blocks 1,2-Cyclopentanediol, 3-methyl-

1,2-Cyclopentanediol, 3-methyl-

CAS No.:
27583-37-5
Catalog Number:
AG002U60
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
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Product Description
Catalog Number:
AG002U60
Chemical Name:
1,2-Cyclopentanediol, 3-methyl-
CAS Number:
27583-37-5
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
MDL Number:
MFCD00019285
IUPAC Name:
3-methylcyclopentane-1,2-diol
InChI:
InChI=1S/C6H12O2/c1-4-2-3-5(7)6(4)8/h4-8H,2-3H2,1H3
InChI Key:
KANFKJUPLALTDB-UHFFFAOYSA-N
SMILES:
OC1C(C)CCC1O
NSC Number:
403839
Properties
Complexity:
82.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.084g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
116.16g/mol
Monoisotopic Mass:
116.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties