200,000+ products from a single source!
sales@angenechem.com
100311-12-4 | Benzoic acid, 4-amino-3-propoxy-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
CAS No: 100311-12-4 Catalog No: AG0001LY MDL No:
Product Description
Catalog Number:
AG0001LY
Chemical Name:
Benzoic acid, 4-amino-3-propoxy-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
CAS Number:
100311-12-4
Molecular Formula:
C16H27ClN2O3
Molecular Weight:
330.8502
IUPAC Name:
2-(diethylamino)ethyl 4-amino-3-propoxybenzoate;hydrochloride
InChI:
InChI=1S/C16H26N2O3.ClH/c1-4-10-20-15-12-13(7-8-14(15)17)16(19)21-11-9-18(5-2)6-3;/h7-8,12H,4-6,9-11,17H2,1-3H3;1H
InChI Key:
SENDDLZRSZXUBH-UHFFFAOYSA-N
SMILES:
CCCOc1cc(ccc1N)C(=O)OCCN(CC)CC.Cl
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.171g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
330.853g/mol
Monoisotopic Mass:
330.171g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
64.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.