200,000+ products from a single source!
sales@angenechem.com
24642-33-9 | Cyclopentanecarboxylic acid, 1-phenyl-, 4-[bis(1-methylethyl)amino]-2-butyn-1-yl ester, hydrochloride (1:1)
CAS No: 24642-33-9 Catalog No: AG002OWE MDL No:
Product Description
Catalog Number:
AG002OWE
Chemical Name:
Cyclopentanecarboxylic acid, 1-phenyl-, 4-[bis(1-methylethyl)amino]-2-butyn-1-yl ester, hydrochloride (1:1)
CAS Number:
24642-33-9
Molecular Formula:
C22H32ClNO2
Molecular Weight:
377.9480
IUPAC Name:
4-[di(propan-2-yl)amino]but-2-ynyl 1-phenylcyclopentane-1-carboxylate;hydrochloride
InChI:
InChI=1S/C22H31NO2.ClH/c1-18(2)23(19(3)4)16-10-11-17-25-21(24)22(14-8-9-15-22)20-12-6-5-7-13-20;/h5-7,12-13,18-19H,8-9,14-17H2,1-4H3;1H
InChI Key:
QWAPXBZACIYRNT-UHFFFAOYSA-N
SMILES:
CC(N(C(C)C)CC#CCOC(=O)C1(CCCC1)c1ccccc1)C.Cl
Properties
Complexity:
477
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.212g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
377.953g/mol
Monoisotopic Mass:
377.212g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.