(N-BOC-Amino)(naphthalen-1-yl)acetic acid - CAS 14675-99-1

Catalog:	BB072528
Product Name:	(N-BOC-Amino)(naphthalen-1-yl)acetic acid
CAS:	14675-99-1
Synonyms:	tert-Butoxycarbonylamino-naphthalen-1-yl-acetic acid; (N-BOC-Amino)(naphthalen-1-yl)acetic acid; 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-naphthalen-1-ylacetic acid; 2-((tert-Butoxycarbonyl)amino)-2-(naphthalen-1-yl)acetic acid; 1-naphthaleneacetic acid,a-[[(1,1-dimethylethoxy)carbonyl]amino]-; Boc-(S)-naphthyl glycine; tert-butoxycarbonylamino-naphthalen-1-yl-aceticacid

Technical Data

IUPAC Name:	2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-naphthalen-1-ylacetic acid
Description:	(N-BOC-Amino)(naphthalen-1-yl)acetic acid
Molecular Weight:	301.34
Molecular Formula:	C17H19NO4
Canonical SMILES:	CC(C)(C)OC(=O)NC(C1=CC=CC2=CC=CC=C21)C(=O)O
InChI:	InChI=1S/C17H19NO4/c1-17(2,3)22-16(21)18-14(15(19)20)13-10-6-8-11-7-4-5-9-12(11)13/h4-10,14H,1-3H3,(H,18,21)(H,19,20)
InChI Key:	HRBQDQOOFCWHTR-UHFFFAOYSA-N

Complexity:	415
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	301.13140809
Formal Charge:	0
Heavy Atom Count:	22
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	301.13140809
Rotatable Bond Count:	5
Topological Polar Surface Area:	75.6Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	3.5