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90904-56-6

90904-56-6 | ETHANEPEROXOIC ACID 2-HYDROXYCYCLOPENTYL ESTER

CAS No: 90904-56-6 Catalog No: AG006GOP MDL No:

Product Description

Catalog Number:
AG006GOP
Chemical Name:
ETHANEPEROXOIC ACID 2-HYDROXYCYCLOPENTYL ESTER
CAS Number:
90904-56-6
Molecular Formula:
C7H12O4
Molecular Weight:
160.1678
IUPAC Name:
(2-hydroxycyclopentyl) ethaneperoxoate
InChI:
InChI=1S/C7H12O4/c1-5(8)10-11-7-4-2-3-6(7)9/h6-7,9H,2-4H2,1H3
InChI Key:
VQJIHHCZRNNFDL-UHFFFAOYSA-N
SMILES:
CC(=O)OOC1CCCC1O

Properties

Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.074g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.169g/mol
Monoisotopic Mass:
160.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

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