C(C#N)C(=O)O
CAS: 372-09-8
الاسم: 2-cyanoacetic acid
SMILES: C(C#N)C(=O)O

Molecular Processing

Molecular formula
C3H3NO2
Molecular weight
85.06
Exact mass
85.0164
XLogP
-0.02
TPSA
61.09
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
6
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
17.87

Supplementary Information

InChIKey: MLIREBYILWEBDM-UHFFFAOYSA-N
مرادفات
CYANOACETIC ACID372-09-82-Cyanoacetic acidAcetic acid, cyano-Malonic mononitrileAcide cyanacetiqueCyanessigsaeureMalonic acid mononitrileMonocyanoacetic acidcyanoethanoic acidUSAF KF-17Kyselina kyanoctovaDTXSID0027149QZT550H2Y9NSC-5571DTXCID707149CHEBI:51889RefChem:129042206-743-9CyanoaceticacidAcetic acid, 2-cyano-NSC 5571MFCD00002677Cyanessigsaeure [German]Acide cyanacetique [French]Kyselina kyanoctova [Czech]CAS-372-09-8HSDB 272EINECS 206-743-9BRN 0506325
عرض المصدر →
مشارك في 780 تفاعل→

بحث موسع

بحث البنية الفرعية→بحث التشابه→