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Home > Nitro Compounds > 885428-60-4
885428-60-4 | α-(1-Methoxypropylidene)-4-nitro-benzeneacetonitrile
CAS No: 885428-60-4 Catalog No: AG00GX9Z MDL No:
Product Description
Catalog Number:
AG00GX9Z
Chemical Name:
α-(1-Methoxypropylidene)-4-nitro-benzeneacetonitrile
CAS Number:
885428-60-4
IUPAC Name:
(Z)-3-methoxy-2-(4-nitrophenyl)pent-2-enenitrile
InChI:
InChI=1S/C12H12N2O3/c1-3-12(17-2)11(8-13)9-4-6-10(7-5-9)14(15)16/h4-7H,3H2,1-2H3/b12-11+
InChI Key:
QYUARODYCMEMQR-VAWYXSNFSA-N
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
232.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.239g/mol
Monoisotopic Mass:
232.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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