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88931-75-3

88931-75-3 | Cyclopentaneacetic acid, 1,1-dimethylethyl ester

CAS No: 88931-75-3 Catalog No: AG0048V0 MDL No:

Product Description

Catalog Number:
AG0048V0
Chemical Name:
Cyclopentaneacetic acid, 1,1-dimethylethyl ester
CAS Number:
88931-75-3
Molecular Formula:
C11H20O2
Molecular Weight:
184.2753
IUPAC Name:
tert-butyl 2-cyclopentylacetate
InChI:
InChI=1S/C11H20O2/c1-11(2,3)13-10(12)8-9-6-4-5-7-9/h9H,4-8H2,1-3H3
InChI Key:
KWOUWJQXSRDGDE-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)CC1CCCC1

Properties

Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.146g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.279g/mol
Monoisotopic Mass:
184.146g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

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