AG00595H

775280-91-6 | (R)-3-Amino-3-(naphthalen-1-yl)propanoic acid

AG00595H

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CAS Number	775280-91-6
Catalog Number	AG00595H(AGN-PC-0UBTTX)
Chemical Name	(R)-3-Amino-3-(naphthalen-1-yl)propanoic acid
IUPAC Name	(3R)-3-amino-3-naphthalen-1-ylpropanoic acid
InChI	InChI=1S/C13H13NO2/c14-12(8-13(15)16)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12H,8,14H2,(H,15,16)/t12-/m1/s1
InChI Key	BIOQBKBTOAMMDG-GFCCVEGCSA-N
MDL Number	MFCD04113637
Molecular Formula	C13H13NO2
Molecular Weight	215.2478
SMILES	C1=CC=C2C(=C1)C=CC=C2[C@@H](CC(=O)O)N
Synonyms	775280-91-6, (R)-3-Amino-3-(1-naphthyl)-propionic acid, (R)-3-Amino-3-(naphthalen-1-yl)propanoic acid, (R)-3-Amino-3-(1-naphthyl)propionic acid, (R)-3-Amino-3-(1-naphthylphenyl)-propionic acid, (3R)-3-amino-3-naphthalen-1-ylpropanoic acid, PubChem24005, AC1OC1L4, SCHEMBL5720984, CTK5E4590, DTXSID80426123, ZINC153464, MFCD04113637, AKOS016843642, AB17701, AJ-12996, PS-12503, AX8047522, RT-005648, 1-Naphthalenepropanoicacid, b-amino-, (bR)-, A-8771, (3R)-3-AMINO-3-(NAPHTHALEN-1-YL)PROPANOIC ACID, CBDivE_003465, CID6930817, (R)-3-Amino-3-(naphthalen-1-yl)propanoicacid,

Complexity	254
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
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	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

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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