AG00CM8X

331847-11-1 | (S)-3-Amino-4-(2,4-dichlorophenyl)butanoic acid hydrochloride

AG00CM8X

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CAS Number	331847-11-1
Catalog Number	AG00CM8X(AGN-PC-0WAMKQ)
Chemical Name	(S)-3-Amino-4-(2,4-dichlorophenyl)butanoic acid hydrochloride
IUPAC Name	(3S)-3-amino-4-(2,4-dichlorophenyl)butanoic acid;hydrochloride
InChI	InChI=1S/C10H11Cl2NO2.ClH/c11-7-2-1-6(9(12)4-7)3-8(13)5-10(14)15;/h1-2,4,8H,3,5,13H2,(H,14,15);1H/t8-;/m0./s1
InChI Key	JNGZEMBEPQATGG-QRPNPIFTSA-N
MDL Number	MFCD01861043
Molecular Formula	C10H12Cl3NO2
Molecular Weight	284.5668
SMILES	Cl[H].N[C@H](CC(O)=O)CC1=CC=C(Cl)C=C1Cl
Synonyms	270063-47-3, (S)-3-AMINO-4-(2,4-DICHLOROPHENYL)BUTANOIC ACID HYDROCHLORIDE, 331847-11-1, (S)-3-AMINO-4-(2,4-DICHLOROPHENYL)-BUTYRIC ACID-HCL, (3S)-3-amino-4-(2,4-dichlorophenyl)butanoic Acid Hydrochloride, 2,4-Dichloro-L-beta-homophenylalanine hydrochloride, (S)-3-Amino-4-(2,4-dichloro-phenyl)-butyric acid-HCl, AC1MC5ED, CTK1A1456, KS-00000FTX, DTXSID90375850, (S)-3-Amino-4-(2,4-dichlorophenyl)butyric acid hydrochloride, (S)-3-Amino-4-(2,4-dichloro-phenyl)butyric acid hydrochloride, CA-531, MFCD01861043, AKOS015948918, DS-3920, AC-22167, ACM270063473, CC-01371, AX8011877, RT-006793, TL8002164, FT-0644271, A-8801, 2,4-Dichloro-L-ss-homophenylalanine hydrochloride, C-17927, (S)-3-Amino-4-(2,4-dichloro-phenyl)-butyric acid HCl, (S)-3-Amino-4-(2,4-dichlorophenyl)butanoic acid HCl, (3S)-3-amino-4-(2,4-dichlorophenyl)butyric acid;hydrochloride, (3S)-3-amino-4-(2,4-dichlorophenyl)butanoic acid;hydrochloride, (3S)-3-azanyl-4-(2,4-dichlorophenyl)butanoic acid;hydrochloride, (3S)-3-Amino-4-(2,4-dichlorophenyl)butanoic acid--hydrogen chloride (1/1), 3,4-Dichloro-Phe-OMe.HCl, CID2761633, -3-AMINO-4- BUTANOICACIDHYDROCHLORIDE,

Complexity	226
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	282.993g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	284.561g/mol
Monoisotopic Mass	282.993g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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

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