(S)-N1-Boc-3-phenyl-1,2-propanediamine - CAS 167298-44-4

Name: (S)-N1-Boc-3-phenyl-1,2-propanediamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB012375
Product Name:	(S)-N1-Boc-3-phenyl-1,2-propanediamine
CAS:	167298-44-4
Synonyms:	N-[(2S)-2-amino-3-phenylpropyl]carbamic acid tert-butyl ester; tert-butyl N-[(2S)-2-amino-3-phenylpropyl]carbamate

Technical Data

IUPAC Name:	tert-butyl N-[(2S)-2-amino-3-phenylpropyl]carbamate
Description:	(S)-N1-Boc-3-phenyl-1,2-propanediamine (CAS# 167298-44-4) is a useful research chemical.
Molecular Weight:	250.34
Molecular Formula:	C14H22N2O2
Canonical SMILES:	CC(C)(C)OC(=O)NCC(CC1=CC=CC=C1)N
InChI:	InChI=1S/C14H22N2O2/c1-14(2,3)18-13(17)16-10-12(15)9-11-7-5-4-6-8-11/h4-8,12H,9-10,15H2,1-3H3,(H,16,17)/t12-/m0/s1
InChI Key:	ADVSLLRGGNVROC-LBPRGKRZSA-N
Boiling Point:	375.2 °C at 760 mmHg
Density:	1.066 g/cm³
MDL:	MFCD06245566
LogP:	3.30230

Publication Number	Title	Priority Date
US-2016102094-A1	Azaquinazoline Inhibitors of Atypical Protein Kinase C	20120928
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Complexity:	255
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	250.168127949
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	250.168127949
Rotatable Bond Count:	6
Topological Polar Surface Area:	64.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2