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73404-99-6 | 2-(ETHYLAMINO)-3-METHYL-2-BUTENENITRILE
CAS No: 73404-99-6 Catalog No: AG005E4C MDL No:
Product Description
Catalog Number:
AG005E4C
Chemical Name:
2-(ETHYLAMINO)-3-METHYL-2-BUTENENITRILE
CAS Number:
73404-99-6
Molecular Formula:
C7H12N2
Molecular Weight:
124.1836
IUPAC Name:
2-(ethylamino)-3-methylbut-2-enenitrile
InChI:
InChI=1S/C7H12N2/c1-4-9-7(5-8)6(2)3/h9H,4H2,1-3H3
InChI Key:
AKOUHQQSMYFMJU-UHFFFAOYSA-N
SMILES:
CCNC(=C(C)C)C#N
Properties
Complexity:
155
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:
1
Isotope Atom Count:
0
Molecular Weight:
124.187g/mol
Monoisotopic Mass:
124.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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