CAS: 26961-27-3
이름: 2-amino-4,5-dimethoxybenzonitrile
SMILES:
COC1=C(C=C(C(=C1)C#N)N)OCMolecular Processing
Molecular formula
C9H10N2O2
Molecular weight
178.19
Exact mass
178.0742
XLogP
1.16
TPSA
68.27
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
48.67
Supplementary Information
InChIKey: BJAYMNUBIULRMF-UHFFFAOYSA-N
동의어
2-Amino-4,5-dimethoxybenzonitrile26961-27-3DTXSID80352892RefChem:463999DTXCID90303956608-025-46-AminoveratronitrileMFCD000586822-Cyano-4,5-Dimethoxyaniline4-Amino-5-cyanoveratrole2-amino-4,5-dimethoxybenzenecarbonitrileBenzonitrile, 2-amino-4,5-dimethoxy-4,5-dimethoxy-2-aminobenzonitrile2-amino-4,5-dimethoxy-benzonitrileChemDiv3_011209SCHEMBL82833BJAYMNUBIULRMF-UHFFFAOYSA-N3,4-dimethoxy-6-aminobenzonitrileHMS1504N11SBB002931STK776272AKOS001848887AC-4017CS-W017332MB00492PS-6197IDI1_028767SY017622DB-047069ST4105021
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