200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 913642-80-5
913642-80-5 | Carbamic acid, N-(2-hydroxyethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]-, 1,1-dimethylethyl ester
CAS No: 913642-80-5 Catalog No: AG01F2T5 MDL No:
Product Description
Catalog Number:
AG01F2T5
Chemical Name:
Carbamic acid, N-(2-hydroxyethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]-, 1,1-dimethylethyl ester
CAS Number:
913642-80-5
Molecular Formula:
C15H20F3NO3
Molecular Weight:
319.3194
IUPAC Name:
tert-butyl N-(2-hydroxyethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate
InChI:
InChI=1S/C15H20F3NO3/c1-14(2,3)22-13(21)19(8-9-20)10-11-4-6-12(7-5-11)15(16,17)18/h4-7,20H,8-10H2,1-3H3
InChI Key:
GRSNOLFNTMKSHB-UHFFFAOYSA-N
SMILES:
OCCN(C(=O)OC(C)(C)C)Cc1ccc(cc1)C(F)(F)F
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.14g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.324g/mol
Monoisotopic Mass:
319.14g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.