200,000+ products from a single source!
sales@angenechem.com
89056-31-5 | Cyclopentanecarboxylic acid, 1-(2-butynyl)-
CAS No: 89056-31-5 Catalog No: AG00429M MDL No:
Product Description
Catalog Number:
AG00429M
Chemical Name:
Cyclopentanecarboxylic acid, 1-(2-butynyl)-
CAS Number:
89056-31-5
Molecular Formula:
C10H14O2
Molecular Weight:
166.2170
IUPAC Name:
1-but-2-ynylcyclopentane-1-carboxylic acid
InChI:
InChI=1S/C10H14O2/c1-2-3-6-10(9(11)12)7-4-5-8-10/h4-8H2,1H3,(H,11,12)
InChI Key:
NMIBFWMSKZDRPK-UHFFFAOYSA-N
SMILES:
CC#CCC1(CCCC1)C(=O)O
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.099g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.22g/mol
Monoisotopic Mass:
166.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
© 2019 Angene International Limited. All rights Reserved.