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Home > Fluorides > 1824534-89-5
1824534-89-5 | Carbamic acid, N-[2-(trifluoromethyl)cyclopropyl]-, 1,1-dimethylethyl ester
CAS No: 1824534-89-5 Catalog No: AG0023W2 MDL No:MFCD24540813
Product Description
Catalog Number:
AG0023W2
Chemical Name:
Carbamic acid, N-[2-(trifluoromethyl)cyclopropyl]-, 1,1-dimethylethyl ester
CAS Number:
1824534-89-5
Molecular Formula:
C9H14F3NO2
Molecular Weight:
225.2082
MDL Number:
MFCD24540813
IUPAC Name:
tert-butyl N-[2-(trifluoromethyl)cyclopropyl]carbamate
InChI:
InChI=1S/C9H14F3NO2/c1-8(2,3)15-7(14)13-6-4-5(6)9(10,11)12/h5-6H,4H2,1-3H3,(H,13,14)
InChI Key:
GCJUZGHULRVKGS-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CC1C(F)(F)F
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.098g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.211g/mol
Monoisotopic Mass:
225.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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