200,000+ products from a single source!
sales@angenechem.com
2070-87-3 | 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(trifluoromethyl)-
CAS No: 2070-87-3 Catalog No: AG002IU2 MDL No:MFCD00115015
Product Description
Catalog Number:
AG002IU2
Chemical Name:
2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(trifluoromethyl)-
CAS Number:
2070-87-3
Molecular Formula:
C10H7F3N2O
Molecular Weight:
228.1706
MDL Number:
MFCD00115015
IUPAC Name:
4-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one
InChI:
InChI=1S/C10H7F3N2O/c11-10(12,13)8-5-9(16)15-7-4-2-1-3-6(7)14-8/h1-4H,5H2,(H,15,16)
InChI Key:
AVYUTTGUWVFRQS-UHFFFAOYSA-N
SMILES:
O=C1CC(=Nc2c(N1)cccc2)C(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:
228.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.174g/mol
Monoisotopic Mass:
228.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.