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74603-42-2 | 2-(DIMETHYLAMINO)-3-PENTENENITRILE
CAS No: 74603-42-2 Catalog No: AG005J4B MDL No:
Product Description
Catalog Number:
AG005J4B
Chemical Name:
2-(DIMETHYLAMINO)-3-PENTENENITRILE
CAS Number:
74603-42-2
Molecular Formula:
C7H12N2
Molecular Weight:
124.1836
IUPAC Name:
2-(dimethylamino)pent-3-enenitrile
InChI:
InChI=1S/C7H12N2/c1-4-5-7(6-8)9(2)3/h4-5,7H,1-3H3
InChI Key:
OOPFLXWMBWABHR-UHFFFAOYSA-N
SMILES:
CC=CC(N(C)C)C#N
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.1g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.187g/mol
Monoisotopic Mass:
124.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
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