200,000+ products from a single source!
sales@angenechem.com
146621-92-3 | Benzeneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-3-(trifluoromethyl)-
CAS No: 146621-92-3 Catalog No: AG001E6V MDL No:MFCD07388839
Product Description
Catalog Number:
AG001E6V
Chemical Name:
Benzeneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-3-(trifluoromethyl)-
CAS Number:
146621-92-3
Molecular Formula:
C14H16F3NO4
Molecular Weight:
319.2763
MDL Number:
MFCD07388839
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[3-(trifluoromethyl)phenyl]acetic acid
InChI:
InChI=1S/C14H16F3NO4/c1-13(2,3)22-12(21)18-10(11(19)20)8-5-4-6-9(7-8)14(15,16)17/h4-7,10H,1-3H3,(H,18,21)(H,19,20)
InChI Key:
NVMKZXKHKQKKFE-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(c1cccc(c1)C(F)(F)F)C(=O)O
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.103g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
319.28g/mol
Monoisotopic Mass:
319.103g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.