ethyl (2E)-2-cyano-3-(dimethylamino)prop-2-enoate

ethyl (2E)-2-cyano-3-(dimethylamino)prop-2-enoate

CAS: 57338-21-3

Formula: C8H12N2O2

SMILES: CCOC(=O)C(=CN(C)C)C#N

IUPAC: ethyl (2E)-2-cyano-3-(dimethylamino)prop-2-enoate

InChI: InChI=1S/C8H12N2O2/c1-4-12-8(11)7(5-9)6-10(2)3/h6H,4H2,1-3H3/b7-6+

Composition: C (57.13%), H (7.19%), N (16.66%), O (19.02%)

Molar Mass: 168.196

Atom Count: 24

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	168.089877634
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	RZEPXNTYHXGQOO-VOTSOKGWSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.57
Topological Polar Surface Area	53.33
Polarizability	17
Ring Count	0
Rotatable Bond Count	4

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