AG00ABD1

184685-17-4 | (R)-2-((tert-Butoxycarbonyl)amino)-3-cyanopropanoic acid

AG00ABD1

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	184685-17-4
Catalog Number	AG00ABD1(AGN-PC-0O5BB1)
Chemical Name	(R)-2-((tert-Butoxycarbonyl)amino)-3-cyanopropanoic acid
IUPAC Name	(2R)-3-cyano-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI	InChI=1S/C9H14N2O4/c1-9(2,3)15-8(14)11-6(4-5-10)7(12)13/h6H,4H2,1-3H3,(H,11,14)(H,12,13)/t6-/m1/s1
InChI Key	IVKMLPKBZQTAMQ-ZCFIWIBFSA-N
MDL Number	MFCD00236830
Molecular Formula	C9H14N2O4
Molecular Weight	214.2185
SMILES	O=C(O)[C@H](NC(OC(C)(C)C)=O)CC#N
Synonyms	184685-17-4, Boc-beta-cyano-D-alanine, Boc-beta-cyano-D-Ala-OH, Boc--cyano-D-Ala-OH, SCHEMBL1952503, CTK8E5720, DTXSID10427148, IVKMLPKBZQTAMQ-ZCFIWIBFSA-N, ZINC2560674, 6288AH, MFCD00236830, AKOS027251071, FCH3647099, ACM184685174, AS-48969, RT-011714, (R)-2-(tert-butoxycarbonylamino)-3-cyanopropanoic acid, PROPANOIC ACID,3-CYANO-2-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-, (2R)-, Boc-b-cyano-D-Ala-OH, C9H14N2O4, CID7019662, (R)-2-((tert-Butoxycarbonyl)amino)-3-cyanopropanoic acid, (2R)-3-cyano-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid,

Complexity	297
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	214.095g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	214.221g/mol
Monoisotopic Mass	214.095g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	99.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number