tert-Butyl (3R,4S)-3-Amino-4-methylpyrrolidine-1-carboxylate - CAS 1152113-30-8

Name: tert-Butyl (3R,4S)-3-Amino-4-methylpyrrolidine-1-carboxylate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB057718
Product Name:	tert-Butyl (3R,4S)-3-Amino-4-methylpyrrolidine-1-carboxylate
CAS:	1152113-30-8
Synonyms:	tert-butyl (3R,4S)-3-amino-4-methylpyrrolidine-1-carboxylate; (3R,4S)-1-Boc-3-amino-4-methylpyrrolidine; (3R,4S)-rel-tert-Butyl 3-amino-4-methylpyrrolidine-1-carboxylate; trans-1-boc-3-amino-4-methylpyrrolidine; tert-butyl trans-3-amino-4-methylpyrrolidine-1-carboxylate; (3R,4S)-tert-Butyl 3-amino-4-methylpyrrolidine-1-carboxylate; 1-Pyrrolidinecarboxylic acid, 3-amino-4-methyl-, 1,1-dimethylethyl ester, (3R,4S)-rel-

Technical Data

IUPAC Name:	tert-butyl (3R,4S)-3-amino-4-methylpyrrolidine-1-carboxylate
Description:	tert-butyl (3R,4S)-3-amino-4-methylpyrrolidine-1-carboxylate (cas# 1152113-30-8) is a useful research chemical.
Molecular Weight:	200.27
Molecular Formula:	C10H20N2O2
Canonical SMILES:	CC1CN(CC1N)C(=O)OC(C)(C)C
InChI:	InChI=1S/C10H20N2O2/c1-7-5-12(6-8(7)11)9(13)14-10(2,3)4/h7-8H,5-6,11H2,1-4H3/t7-,8-/m0/s1
InChI Key:	DUBXUUPBIKNFEA-YUMQZZPRSA-N

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021215545-A1	Anticancer combination therapy with n-(1-acryloyl-azetidin-3-yl)-2-((1h-indazol-3-yl)amino)methyl)-1h-imidazole-5-carboxamide inhibitor of kras-g12c	20200424
US-2021269434-A1	Tricyclic compounds as inhibitors of kras	20200110
WO-2021142252-A1	Tricyclic compounds as inhibitors of kras	20200110
WO-2020123925-A1	Pyrazolopyridine inhibitors of c-jun-n-terminal kinases and uses thereof	20181214
CA-3115126-A1	Pyrazolopyridine inhibitors of c-jun-n-terminal kinases and uses thereof	20181214
AU-2019395255-A1	Pyrazolopyridine inhibitors of c-Jun-N-terminal kinases and uses thereof	20181214
CN-113164477-A	Pyrazolopyridine inhibitors of C-JUN-N-terminal kinase and uses thereof	20181214
EP-3893879-A1	Pyrazolopyridine inhibitors of c-jun-n-terminal kinases and uses thereof	20181214
JP-2022513846-A	Pyrazolopyridine inhibitors of C-JUN-N terminal kinases and their use	20181214
US-2022073512-A1	Pyrazolopyridine inhibitors of c-jun-n-terminal kinases and uses thereof	20181214

Complexity:	223
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	2
Defined Bond Stereocenter Count:	0
Exact Mass:	200.152477885
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	200.152477885
Rotatable Bond Count:	2
Topological Polar Surface Area:	55.6Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8