methyl 2-amino-4-phenylbutanoate hydrochloride

methyl 2-amino-4-phenylbutanoate hydrochloride

CAS: 85808-33-9

Formula: C11H16ClNO2

SMILES: Cl.COC(=O)C(N)CCC1=CC=CC=C1

IUPAC: methyl 2-amino-4-phenylbutanoate hydrochloride

InChI: InChI=1/C11H15NO2.ClH/c1-14-11(13)10(12)8-7-9-5-3-2-4-6-9;/h2-6,10H,7-8,12H2,1H3;1H

Composition: C (57.52%), H (7.02%), Cl (15.43%), N (6.10%), O (13.93%)

Molar Mass: 229.7

Atom Count: 31

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	229.0869565
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PZKOPSSMUBBHMM-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.49
Topological Polar Surface Area	52.32
Polarizability	21.83
Ring Count	1
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<7 Days	85808-33-9		$8.28-$389.16$8.28$12.42$27.95$53.82$91.08$134.55$389.16