AG000YSJ

129042-57-5 | 2-Naphthalenepropanoic acid, β-amino-

AG000YSJ

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CAS Number	129042-57-5
Catalog Number	AG000YSJ(AGN-PC-0PIWSY)
Chemical Name	2-Naphthalenepropanoic acid, β-amino-
IUPAC Name	3-amino-3-naphthalen-2-ylpropanoic acid
InChI	InChI=1S/C13H13NO2/c14-12(8-13(15)16)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12H,8,14H2,(H,15,16)
InChI Key	JASNXOXPNZWQRV-UHFFFAOYSA-N
MDL Number	MFCD01871322
Molecular Formula	C13H13NO2
Molecular Weight	215.2478
SMILES	O=C(O)CC(N)C1=CC=C2C=CC=CC2=C1
Synonyms	129042-57-5, DL-3-Amino-3-(2-naphthyl)propionic acid, 3-AMINO-3-(NAPHTHALEN-2-YL)PROPANOIC ACID, DL-3-Amino-3-(2-naphthyl)-propionic acid, 3-amino-3-(2-naphthyl)-propionic acid, 3-Amino-3-naphthalen-2-yl-propionic acid, 3-AMINO-3-(2-NAPHTHYL)PROPIONIC ACID, 3-(2-NAPHTHYL)-BETA-ALANINE, 3-AMINO-3-(2-NAPHTHYL)PROPANOIC ACID, (3R)-3-amino-3-naphthalen-2-ylpropanoic acid, PubChem14761, SCHEMBL5720949, DTXSID10441748, ACT04396, KS-000000OY, FD1088, MFCD01871322, 3-Amino-3-(2-naphthyl)propionicacid, dl-3-amino-3-(2-naphthyl)propionic, AKOS000177444, AKOS016842460, AB10472, MCULE-9370553061, NE52292, 2-Naphthalenepropanoic acid, beta-amino-, AC-23769, AK-44809, AN-32419, DS-13402, SY033887, 3-amino-3-(2-naphthalenyl)propanoic acid, 3-azanyl-3-naphthalen-2-yl-propanoic acid, AB0035409, FT-0687320, ST24030396, X9741, beta-(beta-naphthyl)-beta-aminopropionic acid, J3.590.242B, MFCD01871322 (95%), (3S)-3-amino-3-naphthalen-2-ylpropanoic acid, 042A575, A805893, I14-8478, Z1708090069, 5-Hydroxy-2-iodopyridine, C13H13NO2, ACN-055112, CID10560626, 3-amino-3-naphthalen-2-yl-propanoic Acid, (R)-3-Amino-3-(naphthalen-2-yl)propanoic acid, (S)-3-Amino-3-(naphthalen-2-yl)propanoic acid, 767282-94-0, 786637-72-7,

Complexity	254
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.095g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	215.252g/mol
Monoisotopic Mass	215.095g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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