AG00DG1D

53386-64-4 | Glycine, N-(phenylMethyl)-, Methyl ester

AG00DG1D

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CAS Number	53386-64-4
Catalog Number	AG00DG1D(AGN-PC-0DAUF9)
Chemical Name	Glycine, N-(phenylMethyl)-, Methyl ester
IUPAC Name	methyl 2-(benzylamino)acetate
InChI	InChI=1S/C10H13NO2/c1-13-10(12)8-11-7-9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3
InChI Key	UAWVZBDVSNLPDT-UHFFFAOYSA-N
MDL Number	MFCD03247461
Molecular Formula	C10H13NO2
Molecular Weight	179.2157
SMILES	O=C(OC)CNCC1=CC=CC=C1
Synonyms	methyl 2-(benzylamino)acetate, 17136-35-5, 53386-64-4, N-benzylglycine methyl ester, Glycine, N-(phenylmethyl)-, methyl ester, Glycine,N-(phenylmethyl)-, methyl ester, hydrochloride (9CI), AC1L9MMY, benzyl glycine methyl ester, n-benzyl glycine methyl ester, SCHEMBL717052, AC1Q447P, CTK4D3918, DTXSID80329665, UAWVZBDVSNLPDT-UHFFFAOYSA-N, KS-00000GK6, ANW-42598, MFCD03247461, ZINC57214376, AKOS000228036, ACN-048953, CS-W022790, MCULE-3784754204, VZ32986, AK-62852, BR-62852, DA-17857, SC-73836, TS-00193, AJ-112816, TC-131343, 4CH-007452, FT-0722244, ST24030901, W3738, EN300-48624, S-2109, Z138464916, BZL-GLY-OME HCl, C10H13NO2, CID422659, NSC145674,

Complexity	153
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	1
Isotope Atom Count	0
Molecular Weight	179.219g/mol
Monoisotopic Mass	179.095g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H227-H314-H412
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 3265

Certificate of Analysis

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