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1823-99-0 | 2-Propenenitrile, 3-amino-3-phenyl-
CAS No: 1823-99-0 Catalog No: AG0023MA MDL No:MFCD00015933
Product Description
Catalog Number:
AG0023MA
Chemical Name:
2-Propenenitrile, 3-amino-3-phenyl-
CAS Number:
1823-99-0
Molecular Formula:
C9H8N2
Molecular Weight:
144.1732
MDL Number:
MFCD00015933
IUPAC Name:
(Z)-3-amino-3-phenylprop-2-enenitrile
InChI:
InChI=1S/C9H8N2/c10-7-6-9(11)8-4-2-1-3-5-8/h1-6H,11H2/b9-6-
InChI Key:
GDJDODGBGRBEAN-TWGQIWQCSA-N
SMILES:
N#CC=C(c1ccccc1)N
EC Number:
217-355-4
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
144.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.177g/mol
Monoisotopic Mass:
144.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Single-hole hollow nanospheres from enantioselective self-assembly of chiral AIE carboxylic acid and amine. | The Journal of organic chemistry 20110218 |
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