AG002MBG

23135-50-4 | Pentanoic acid, 5-[[(phenylmethoxy)carbonyl]amino]-

AG002MBG

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CAS Number	23135-50-4
Catalog Number	AG002MBG(AGN-PC-0KYO5H)
Chemical Name	Pentanoic acid, 5-[[(phenylmethoxy)carbonyl]amino]-
IUPAC Name	5-(phenylmethoxycarbonylamino)pentanoic acid
InChI	InChI=1S/C13H17NO4/c15-12(16)8-4-5-9-14-13(17)18-10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,(H,14,17)(H,15,16)
InChI Key	QYYPKLYDFCYGPG-UHFFFAOYSA-N
MDL Number	MFCD00188458
Molecular Formula	C13H17NO4
Molecular Weight	251.2784
SMILES	O=C(O)CCCCNC(OCC1=CC=CC=C1)=O
Synonyms	23135-50-4, Z-5-Ava-OH, 5-BENZYLOXYCARBONYLAMINO-PENTANOIC ACID, 5-(((Benzyloxy)carbonyl)amino)pentanoic acid, 5-(benzyloxycarbonylamino)pentanoic acid, 5-{[(benzyloxy)carbonyl]amino}pentanoic acid, 5-(Carbobenzoxyamino)valeric Acid, 5-(Carbobenzoxyamino)pentanoic Acid, 5-(phenylmethoxycarbonylamino)pentanoic acid, 5-Benzyloxycarbonylamino-pentanoicacid, MFCD00188458, N-5-Carbobenzoxy-5-aminopentanoic acid, AC1MVWEY, PubChem20738, N-Cbz-5-aminovaleric Acid, AC1Q75GM, N-Cbz-5-aminopentanoic Acid, SCHEMBL879577, 5-(Carbobenzoxyamino)valericAcid, DTXSID00395089, QYYPKLYDFCYGPG-UHFFFAOYSA-N, ZINC2030656, 5-(benzyloxycarbonylamino)valeric acid, AKOS013375859, AM84809, CM14119, LS10056, MCULE-9169261832, NE52615, RP28951, RP28954, KS-000016X0, AJ-32897, AS-19630, BC206386, QC-10399, SC-53131, 5-(N-benzyloxycarbonylamino)pentanoic acid, AB0098077, FT-0753388, ST24044139, J-014998, J-516760, I14-99676, Pentanoic acid, 5-[[(phenylmethoxy)carbonyl]amino]-, Z1428159365, ACN-038208, CID3690024, 5-phenylmethoxycarbonylaminopentanoic Acid, 5-(((Benzyloxy)carbonyl)amino)pentanoicacid, C2067,

Complexity	262
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	251.116g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	251.282g/mol
Monoisotopic Mass	251.116g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number