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Home > Other Heterocycles > 89898-01-1

89898-01-1

89898-01-1 | Bicyclo[2.2.1]heptan-2-one, 3-hydroxy-

CAS No: 89898-01-1 Catalog No: AG006OVS MDL No:

Product Description

Catalog Number:
AG006OVS
Chemical Name:
Bicyclo[2.2.1]heptan-2-one, 3-hydroxy-
CAS Number:
89898-01-1
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
IUPAC Name:
3-hydroxybicyclo[2.2.1]heptan-2-one
InChI:
InChI=1S/C7H10O2/c8-6-4-1-2-5(3-4)7(6)9/h4-6,8H,1-3H2
InChI Key:
LHQWPNKPOSHHJA-UHFFFAOYSA-N
SMILES:
OC1C2CCC(C1=O)C2

Properties

Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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