(2S)-2-amino-4-oxo-4-phenylbutanoic acid hydrochloride

(2S)-2-amino-4-oxo-4-phenylbutanoic acid hydrochloride

CAS: 168154-76-5

Formula: C10H12ClNO3

SMILES: Cl.N[C@@H](CC(=O)C1=CC=CC=C1)C(O)=O

IUPAC: (2S)-2-amino-4-oxo-4-phenylbutanoic acid hydrochloride

InChI: InChI=1S/C10H11NO3.ClH/c11-8(10(13)14)6-9(12)7-4-2-1-3-5-7;/h1-5,8H,6,11H2,(H,13,14);1H/t8-;/m0./s1

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	1
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	QSZYKVGEOKNNOP-QRPNPIFTSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.35
Topological Polar Surface Area	80.39
Polarizability	19.8
Ring Count	1
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	168154-76-5		$37.83-$312.73$37.83$58.01$312.73