AG0022QZ

181227-47-4 | 1H-Indene-2-acetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2,3-dihydro-, (αS)-

AG0022QZ

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CAS Number	181227-47-4
Catalog Number	AG0022QZ(AGN-PC-0QBYY3)
Chemical Name	1H-Indene-2-acetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2,3-dihydro-, (αS)-
IUPAC Name	(2S)-2-(2,3-dihydro-1H-inden-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
InChI	InChI=1S/C16H21NO4/c1-16(2,3)21-15(20)17-13(14(18)19)12-8-10-6-4-5-7-11(10)9-12/h4-7,12-13H,8-9H2,1-3H3,(H,17,20)(H,18,19)/t13-/m0/s1
InChI Key	VCHHRDDQOOBPTC-ZDUSSCGKSA-N
MDL Number	MFCD00671384
Molecular Formula	C16H21NO4
Molecular Weight	291.3422
SMILES	O=C(O)[C@@H](NC(OC(C)(C)C)=O)C1CC2=C(C=CC=C2)C1
Synonyms	181227-47-4, (S)-2-((tert-Butoxycarbonyl)amino)-2-(2,3-dihydro-1H-inden-2-yl)acetic acid, (S)-N-Boc-2-indanylglycine, boc-l-2-indanylglycine, Boc-(2-indanyl)-Gly-OH, boc-(2-inda)gly-oh, (S)-TERT-BUTOXYCARBONYLAMINO-INDAN-1-YL-ACETIC ACID, (s)-2-(tert-butoxycarbonylamino)-2-(2,3-dihydro-1h-inden-2-yl)acetic acid, Boc-L-2-indanyglycine, boc-indanylgly-oh, boc-(2-indanyl)-oh, PubChem23310, boc-l-alpha-indanylglycine, SCHEMBL5389519, CTK8B9017, DTXSID30654353, ZINC2567258, ANW-61826, MFCD00671384, AKOS015909033, RTR-008327, ACM181227474, AJ-41374, AN-30590, AS-39968, AX8049275, TR-008327, A4017, FT-0679751, Boc-(2-indanyl)-Gly-OH, >=98.0% (HPLC), 227B474, n-alpha-t-butoxycarbonyl-l-alpha-2-indanyl-glycine, J-011574, I14-33284, (2S)-2-(tert-butoxycarbonylamino)-2-indan-2-yl-acetic acid, 2-(tert-butoxycarbonyl(2,3-dihydro-1H-inden-2-yl)amino)acetic acid, (2S)-[(tert-Butoxycarbonyl)amino](2,3-dihydro-1H-inden-2-yl)acetic acid, (S)-[(tert-butoxycarbonyl)amino](2,3-dihydro-1H-inden-2-yl)acetic acid, 1H-Indene-2-acetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-2,3-dihydro-, (alphaS)-, N-alpha-t-Butyloxycarbonyl-2-indanyl-L-glycine, (S)-2-(t-Butyloxycarbonylamino)-2-(2,3-dihydro-1H-inden-2-yl)acetic acid, CB11729, (S)-2-((tert-Butoxycarbonyl)amino)-2-(2,3-dihydro-1H-inden-2-yl)aceticacid,

Complexity	388
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	291.147g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	291.347g/mol
Monoisotopic Mass	291.147g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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