Name: Name:2,2,2-trifluoroethyl N-(2-oxoazepan-3-yl)carbamate
Brand: Angene
SKU: AG01A9WJ
Rating: 90 (10 reviews)

2,2,2-trifluoroethyl N-(2-oxoazepan-3-yl)carbamate

CAS No.:

1214168-04-3

Catalog Number:

AG01A9WJ

Molecular Formula:

C9H13F3N2O3

Molecular Weight:

254.2063

Catalog Number:

AG01A9WJ

Chemical Name:

2,2,2-trifluoroethyl N-(2-oxoazepan-3-yl)carbamate

CAS Number:

1214168-04-3

Molecular Formula:

C9H13F3N2O3

Molecular Weight:

254.2063

MDL Number:

MFCD13615388

IUPAC Name:

2,2,2-trifluoroethyl N-(2-oxoazepan-3-yl)carbamate

InChI:

InChI=1S/C9H13F3N2O3/c10-9(11,12)5-17-8(16)14-6-3-1-2-4-13-7(6)15/h6H,1-5H2,(H,13,15)(H,14,16)

InChI Key:

PUSDFCJDZUCMSQ-UHFFFAOYSA-N

SMILES:

O=C(NC1CCCCNC1=O)OCC(F)(F)F

Complexity:

294

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.088g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.209g/mol

Monoisotopic Mass:

254.088g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3