200,000+ products from a single source!
sales@angenechem.com
1233512-89-4 | 3-Amino-4-(trifluoromethyl)phenylacetylene
CAS No: 1233512-89-4 Catalog No: AG01FB6V MDL No:
Product Description
Catalog Number:
AG01FB6V
Chemical Name:
3-Amino-4-(trifluoromethyl)phenylacetylene
CAS Number:
1233512-89-4
Molecular Formula:
C9H6F3N
Molecular Weight:
185.1458
IUPAC Name:
5-ethynyl-2-(trifluoromethyl)aniline
InChI:
InChI=1S/C9H6F3N/c1-2-6-3-4-7(8(13)5-6)9(10,11)12/h1,3-5H,13H2
InChI Key:
FGVOWDYPSMOMME-UHFFFAOYSA-N
SMILES:
C#Cc1ccc(c(c1)N)C(F)(F)F
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.045g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.149g/mol
Monoisotopic Mass:
185.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.