4-(2-aminophenyl)-4-oxobutanoic acid hydrochloride

4-(2-aminophenyl)-4-oxobutanoic acid hydrochloride

Formula: C10H12ClNO3

SMILES: Cl.NC1=CC=CC=C1C(=O)CCC(O)=O

IUPAC: 4-(2-aminophenyl)-4-oxobutanoic acid hydrochloride

InChI: InChI=1S/C10H11NO3.ClH/c11-8-4-2-1-3-7(8)9(12)5-6-10(13)14;/h1-4H,5-6,11H2,(H,13,14);1H

Composition: C (52.30%), H (5.27%), Cl (15.44%), N (6.10%), O (20.90%)

Molar Mass: 229.66

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	229.050571
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	QXTYCKGXWPSYPB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.05
Topological Polar Surface Area	80.39
Polarizability	19.43
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C10H12ClNO3		Quote Only