(Z)-3-(1H-Indol-3-yl)acrylonitrile


Chemical Name: (Z)-3-(1H-Indol-3-yl)acrylonitrile
CAS Number: 85452-79-5
Product Number: AG00GA4N(AGN-PC-0WAINE)
Synonyms:
MDL No:
Molecular Formula: C11H8N2
Molecular Weight: 168.1946

Identification/Properties


Computed Properties
Molecular Weight:
168.199g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
168.069g/mol
Monoisotopic Mass:
168.069g/mol
Topological Polar Surface Area:
39.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
248
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback