Home Other Building Blocks 2,2,2-trifluoroethyl N-(3,4-diethoxyphenyl)carbamate

2,2,2-trifluoroethyl N-(3,4-diethoxyphenyl)carbamate

CAS No.:
95261-54-4
Catalog Number:
AG019QSW
Molecular Formula:
C13H16F3NO4
Molecular Weight:
307.2656
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Product Description
Catalog Number:
AG019QSW
Chemical Name:
2,2,2-trifluoroethyl N-(3,4-diethoxyphenyl)carbamate
CAS Number:
95261-54-4
Molecular Formula:
C13H16F3NO4
Molecular Weight:
307.2656
MDL Number:
MFCD11099804
IUPAC Name:
2,2,2-trifluoroethyl N-(3,4-diethoxyphenyl)carbamate
InChI:
InChI=1S/C13H16F3NO4/c1-3-19-10-6-5-9(7-11(10)20-4-2)17-12(18)21-8-13(14,15)16/h5-7H,3-4,8H2,1-2H3,(H,17,18)
InChI Key:
PCUBJOHLSVDTBN-UHFFFAOYSA-N
SMILES:
CCOc1cc(ccc1OCC)NC(=O)OCC(F)(F)F
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.103g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
307.269g/mol
Monoisotopic Mass:
307.103g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties