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Home > Fluorides > 144298-04-4
144298-04-4 | Carbamic acid, N-(3,4-difluorophenyl)-, 1,1-dimethylethyl ester
CAS No: 144298-04-4 Catalog No: AG001J9C MDL No:MFCD04035655
Product Description
Catalog Number:
AG001J9C
Chemical Name:
Carbamic acid, N-(3,4-difluorophenyl)-, 1,1-dimethylethyl ester
CAS Number:
144298-04-4
Molecular Formula:
C11H13F2NO2
Molecular Weight:
229.2232
MDL Number:
MFCD04035655
IUPAC Name:
tert-butyl N-(3,4-difluorophenyl)carbamate
InChI:
InChI=1S/C11H13F2NO2/c1-11(2,3)16-10(15)14-7-4-5-8(12)9(13)6-7/h4-6H,1-3H3,(H,14,15)
InChI Key:
WIUZQRIAAKGULG-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(c(c1)F)F
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.091g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.227g/mol
Monoisotopic Mass:
229.091g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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