Name: Name:tert-butyl N-(2-carbamothioylethyl)-N-methylcarbamate
Brand: Angene
SKU: AG01A967
Rating: 90 (10 reviews)

tert-butyl N-(2-carbamothioylethyl)-N-methylcarbamate

CAS No.:

347190-30-1

Catalog Number:

AG01A967

Molecular Formula:

C9H18N2O2S

Molecular Weight:

218.3164

Catalog Number:

AG01A967

Chemical Name:

tert-butyl N-(2-carbamothioylethyl)-N-methylcarbamate

CAS Number:

347190-30-1

Molecular Formula:

C9H18N2O2S

Molecular Weight:

218.3164

MDL Number:

MFCD16829990

IUPAC Name:

tert-butyl N-(3-amino-3-sulfanylidenepropyl)-N-methylcarbamate

InChI:

InChI=1S/C9H18N2O2S/c1-9(2,3)13-8(12)11(4)6-5-7(10)14/h5-6H2,1-4H3,(H2,10,14)

InChI Key:

YXJQGJIMJWMBRI-UHFFFAOYSA-N

SMILES:

CN(C(=O)OC(C)(C)C)CCC(=S)N

Complexity:

223

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

218.109g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

218.315g/mol

Monoisotopic Mass:

218.109g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6