200,000+ products from a single source!
sales@angenechem.com
88931-76-4 | Cyclopentaneacetic acid, 1-methyl-, 1,1-dimethylethyl ester
CAS No: 88931-76-4 Catalog No: AG0048UZ MDL No:
Product Description
Catalog Number:
AG0048UZ
Chemical Name:
Cyclopentaneacetic acid, 1-methyl-, 1,1-dimethylethyl ester
CAS Number:
88931-76-4
Molecular Formula:
C12H22O2
Molecular Weight:
198.3019
IUPAC Name:
tert-butyl 2-(1-methylcyclopentyl)acetate
InChI:
InChI=1S/C12H22O2/c1-11(2,3)14-10(13)9-12(4)7-5-6-8-12/h5-9H2,1-4H3
InChI Key:
WFIWOHUJVMMDOQ-UHFFFAOYSA-N
SMILES:
O=C(CC1(C)CCCC1)OC(C)(C)C
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.162g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.306g/mol
Monoisotopic Mass:
198.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
© 2019 Angene International Limited. All rights Reserved.