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294187-76-1 | Carbamic acid, (4-azido-2,3,5,6-tetrafluorophenyl)-, 1,1-dimethylethyl ester (9CI)
CAS No: 294187-76-1 Catalog No: AG002YAZ MDL No:
Product Description
Catalog Number:
AG002YAZ
Chemical Name:
Carbamic acid, (4-azido-2,3,5,6-tetrafluorophenyl)-, 1,1-dimethylethyl ester (9CI)
CAS Number:
294187-76-1
Molecular Formula:
C11H10F4N4O2
Molecular Weight:
306.2163
IUPAC Name:
tert-butyl N-(4-azido-2,3,5,6-tetrafluorophenyl)carbamate
InChI:
InChI=1S/C11H10F4N4O2/c1-11(2,3)21-10(20)17-8-4(12)6(14)9(18-19-16)7(15)5(8)13/h1-3H3,(H,17,20)
InChI Key:
QHWSSUUXMVEFHZ-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1c(F)c(F)c(c(c1F)F)NC(=O)OC(C)(C)C
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.074g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
306.221g/mol
Monoisotopic Mass:
306.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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