AG003OF9

10436-25-6 | Boc-11-Aminoundecanoic acid

AG003OF9

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CAS Number	10436-25-6
Catalog Number	AG003OF9(AGN-PC-0L7L7E)
Chemical Name	Boc-11-Aminoundecanoic acid
IUPAC Name	11-[(2-methylpropan-2-yl)oxycarbonylamino]undecanoic acid
InChI	InChI=1S/C16H31NO4/c1-16(2,3)21-15(20)17-13-11-9-7-5-4-6-8-10-12-14(18)19/h4-13H2,1-3H3,(H,17,20)(H,18,19)
InChI Key	HPTPZJBSQUULAV-UHFFFAOYSA-N
MDL Number	MFCD00076902
Molecular Formula	C16H31NO4
Molecular Weight	301.4216
SMILES	CC(C)(C)OC(=O)NCCCCCCCCCCC(O)=O
Synonyms	10436-25-6, Boc-11-aminoundecanoic acid, 11-((tert-Butoxycarbonyl)amino)undecanoic acid, 11-(boc-amino)-undecanoic acid, 11-(tert-Butoxycarbonylamino)undecanoic acid, 11-[(tert-butoxycarbonyl)amino]undecanoic acid, Boc-11-Aun-OH, AC1N64RW, SCHEMBL826376, 11-(Boc-amino)undecanoic acid, N-BOC-11-aminoundecanoic acid, 11-[(2-methylpropan-2-yl)oxycarbonylamino]undecanoic Acid, DTXSID60401054, HPTPZJBSQUULAV-UHFFFAOYSA-N, ACT07196, KS-00000K8S, ZINC4899526, ANW-74060, MFCD00076902, AKOS016008635, AM82458, 11-tert-Butoxycarbonylaminoundecanoic acid, AJ-52558, AK-87065, DS-18269, 11-tert-Butoxycarbonylamino-undecanoic acid, AX8030015, TC-162805, 4CH-021990, Boc-11-Aun-OH, >=98.0% (TLC), FT-0679716, ST24038231, K-0415, 11-amino-12-tert-butoxy-12-oxododecanoic acid, N-(tert-butoxycarbonyl)-11-aminoundecanoic acid, 436B256, C-54775, N-T-BUTYLOXYCARBONYL-11-AMINO-UNDECANOIC ACID, CID4229290, 11-((tert-Butoxycarbonyl)amino)undecanoicacid, Undecanoic acid,11-[[(1,1-dimethylethoxy)carbonyl]amino]-,

Complexity	297
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	301.225g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	301.427g/mol
Monoisotopic Mass	301.225g/mol
Rotatable Bond Count	13
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

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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