AG0003XZ

1012-05-1 | Benzenebutanoic acid, α-amino-

AG0003XZ

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CAS Number	1012-05-1
Catalog Number	AG0003XZ(AGN-PC-0OQEGC)
Chemical Name	Benzenebutanoic acid, α-amino-
IUPAC Name	2-amino-4-phenylbutanoic acid
InChI	InChI=1S/C10H13NO2/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)
InChI Key	JTTHKOPSMAVJFE-UHFFFAOYSA-N
MDL Number	MFCD00063092
Molecular Formula	C10H13NO2
Molecular Weight	179.2157
SMILES	O=C(O)C(N)CCC1=CC=CC=C1
Synonyms	(S)-2-amino-4-phenylbutanoic acid, 2-amino-4-phenylbutanoic acid, DL-Homophenylalanine, 2-Amino-4-phenylbutanoic acid, 1012-05-1, h-dl-hophe-oh, 2-Amino-4-phenylbutyric acid, h-hophe-oh, (-)-2-Amino-4-phenylbutyric acid, H-DL-HOMOPHE-OH, H-DL-HPH-OH, 2-amino-4-phenyl-butyric acid, CHEMBL203873, 7636-28-4, Benzylalanine, JTTHKOPSMAVJFE-UHFFFAOYSA-N, Benzenebutanoic acid, alpha-amino-, (RS)-2-AMINO-4-PHENYL-BUTYRIC ACID, dlhpa, rac-2-amino-4-phenylbutanoic acid, d,l-homophenylalanine, ACMC-209tws, AC1L2SZU, DL-Homophenylalanine, 98%, KSC492S1B, SCHEMBL130567, AC1Q50B0, AC1Q5S74, 2-azanyl-4-phenyl-butanoic acid, CTK3J2910, KS-00000FXF, BCP11593, ANW-43034, BDBM50179729, MFCD00063092, STL481979, [-/+]-2-amino-4-phenylbutyric acid, AKOS000184444, AKOS016038570, (2RS)-2-Amino-4-phenylbutanoic Acid, AB02512, MCULE-6298102909, RP03159, RTR-025864, TRA0025393, TRA0075166, VC30938, AK-44092, AK-47396, AK-80198, AS-17599, SC-10977, SY012060, SY012187, AB0020111, DL-ALPHA-AMINO-4-PHENYLBUTYRIC ACID, ST2404129, TR-000341, TR-025864, 4CH-018957, AM20060478, FT-0633244, FT-0691544, ST45026735, V0875, Y4025, MFCD00002619 (98%), MFCD00063091 (98%), M-2639, 012H051, A800353, Benzenebutanoic acid, .alpha.-amino-, (.+/-.)-, I01-0617, I01-0762, I14-5266, J-507879, I14-44774, F8881-6103, Z1762658322, ( inverted exclamation markA)-2-Amino-4-phenylbutyric acid, L-Homophenylalanine, D-Homophenylalanine, h-d-hophe-oh, Homophenylalanine, UNII-NTL1IB8F3L, 4-Phenyl-2-aminobutyrate, NTL1IB8F3L, D0D7FX, alpha-Aminobenzenebutanoic acid, 2-Amino-4-phenylbutanoicacid, 2-amino-4-phenyl-butanoicacid, (s)-2-amino-4-phenylbutanoic acid, C10H13NO2, 82795-51-5, Alfa-Amino-3-pyridinebutanoic acid, AR-1D8392, C10-H13-N-O2, CID102530, MFCD00063091, ACN-034075, DL-Homophenylalanine, 98% - 1G 1g, 943-73-7, 2-amino-4-phenylbutyric acid, (S)-isomer, 2-amino-4-phenylbutyric acid, hydrochloride, 2-amino-4-phenylbutyric acid, (+-)-isomer, H1329, C014328, 15099-85-1, 87769-39-9,

Complexity	164
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.095g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	179.219g/mol
Monoisotopic Mass	179.095g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number