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160502-09-0 | Carbamic acid, N-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]-, 1,1-dimethylethyl ester
CAS No: 160502-09-0 Catalog No: AG001RZH MDL No:
Product Description
Catalog Number:
AG001RZH
Chemical Name:
Carbamic acid, N-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]-, 1,1-dimethylethyl ester
CAS Number:
160502-09-0
Molecular Formula:
C9H15F3N2O3
Molecular Weight:
256.2222
IUPAC Name:
tert-butyl N-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]carbamate
InChI:
InChI=1S/C9H15F3N2O3/c1-8(2,3)17-7(16)14-5-4-13-6(15)9(10,11)12/h4-5H2,1-3H3,(H,13,15)(H,14,16)
InChI Key:
LRIIKOSSPGMOTQ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCNC(=O)C(F)(F)F
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.103g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.225g/mol
Monoisotopic Mass:
256.103g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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