Boc-D-serine Benzylamide - CAS 1253790-58-7

Name: Boc-D-serine Benzylamide
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB072403
Product Name:	Boc-D-serine Benzylamide
CAS:	1253790-58-7
Synonyms:	BOC-D-SERINE BENZYLAMIDE; (R)-N-benzyl-2-(tert-butoxycarbonylamino)-3-hydroxypropionamide; (R)-tert-Butyl (1-(benzylamino)-3-hydroxy-1-oxopropan-2-yl)carbamate; tert-Butyl (R)-(1-(benzylamino)-3-hydroxy-1-oxopropan-2-yl)carbamate; tert-butyl N-[(2R)-1-(benzylamino)-3-hydroxy-1-oxopropan-2-yl]carbamate; tert-butyl [(1R)-2-(benzylamino)-1-(hydroxymethyl)-2-oxoethyl]carbamate; tert-Butyl ((1R)-2-(benzylamino)-1-(hydroxymethyl)-2-oxoethyl)carbamate

Technical Data

IUPAC Name:	tert-butyl N-[(2R)-1-(benzylamino)-3-hydroxy-1-oxopropan-2-yl]carbamate
Molecular Weight:	294.35
Molecular Formula:	C15H22N2O4
Canonical SMILES:	CC(C)(C)OC(=O)NC(CO)C(=O)NCC1=CC=CC=C1
InChI:	InChI=1S/C15H22N2O4/c1-15(2,3)21-14(20)17-12(10-18)13(19)16-9-11-7-5-4-6-8-11/h4-8,12,18H,9-10H2,1-3H3,(H,16,19)(H,17,20)/t12-/m1/s1
InChI Key:	CTFYHNRRPGOYJS-GFCCVEGCSA-N
References:	Anon. IP.com Journal, 10, 11 (2010).

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501
Signal Word:	Warning

Complexity:	346
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	294.15795719
Formal Charge:	0
Heavy Atom Count:	21
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	294.15795719
Rotatable Bond Count:	7
Topological Polar Surface Area:	87.7Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1