AG005R5J

67098-56-0 | 3-Tert-Butoxycarbonylamino-2-Phenyl-Propionic Acid

AG005R5J

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CAS Number	67098-56-0
Catalog Number	AG005R5J(AGN-PC-0TN3UL)
Chemical Name	3-Tert-Butoxycarbonylamino-2-Phenyl-Propionic Acid
IUPAC Name	3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylpropanoic acid
InChI	InChI=1S/C14H19NO4/c1-14(2,3)19-13(18)15-9-11(12(16)17)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)
InChI Key	PZRXRMWHLUUHFB-UHFFFAOYSA-N
MDL Number	MFCD03003692
Molecular Formula	C14H19NO4
Molecular Weight	265.3050
SMILES	O=C(O)C(C1=CC=CC=C1)CNC(OC(C)(C)C)=O
Synonyms	67098-56-0, 3-tert-Butoxycarbonylamino-2-phenyl-propionic acid, 3-((tert-Butoxycarbonyl)amino)-2-phenylpropanoic acid, N-Boc-3-amino-2-phenyl-propionic acid, 3-{[(tert-butoxy)carbonyl]amino}-2-phenylpropanoic acid, 3-[[[(1,1-Dimethylethyl)oxy]carbonyl]amino]-2-phenylpropanoic acid, 3-[(TERT-BUTOXYCARBONYL)AMINO]-2-PHENYLPROPANOIC ACID, 3-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-2-phenylpropanoic acid, AK119221, AK119224, ACMC-20apio, AC1MBSJY, PubChem22933, TMBTX03, ACMC-1B6YV, SCHEMBL118384, (2S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylpropanoic acid, CTK7G9208, DTXSID20373182, PZRXRMWHLUUHFB-UHFFFAOYSA-N, ANW-35293, MFCD03003692, 3-(boc-amino)-2-phenylpropanoic acid, 3-(Boc-amino)-2-phenylpropionic acid, AKOS012179824, MCULE-7659124030, AS-17242, DB-073836, N-(t-butoxycarbonyl)-2-phenyl-beta-alanine, TC-124038, (r,s)-boc-3-amino-2-phenyl-propionic acid, boc-(r, s)-3-amino-2-phenylpropionic acid, FT-0687533, ST24022514, (r,s)-2-phenyl-3-(boc-amino)propanoic acid, EN300-66019, 3-(tert-butoxycarbonyl)-2-phenylpropanoic acid, A24302, M-1472, 3-tert-butoxycarbonylamino-2-phenyl propionic acid, 3-(tert-butoxycarbonylamino)-2-phenylpropanoic acid, 3- tert -Butoxycarbonylamino-2-phenyl-propionic acid, (R,S)-Boc-3-amino-2-phenyl-propionic acid AldrichCPR, (R,S)-Boc-3-amino-2-phenyl-propionic acid, AldrichCPR, Z1267773715, 3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylpropanoic acid, C14H19NO4, CID2755992, (R)-3-(Boc-amino)-2-phenylpropionic acid, (S)-3-((tert-Butoxycarbonyl)amino)-2-phenylpropanoic acid, (R)-3-((tert-Butoxycarbonyl)amino)-2-phenylpropanoic acid, 136916-26-2, 181140-88-5, 3-TERT-BUTOXYCARBONYLAMINO-2-PHENYL-PROPIONICACID, rac 3-Bocamino-2-phenyl-propionic acid, 98% - 1G 1g, 3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-propanoic Acid, (2R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylpropanoic acid,

Complexity	316
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.131g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	265.309g/mol
Monoisotopic Mass	265.131g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

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