CCOC(=O)C1=CN(N=C1N)C2CC2
CAS: 950859-91-3
الاسم: ethyl 3-amino-1-cyclopropylpyrazole-4-carboxylate
SMILES: CCOC(=O)C1=CN(N=C1N)C2CC2

Molecular Processing

Molecular formula
C9H13N3O2
Molecular weight
195.22
Exact mass
195.1008
XLogP
0.98
TPSA
70.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
50.87

Supplementary Information

InChIKey: MPILNXJBRUVNHX-UHFFFAOYSA-N
مرادفات
SCHEMBL1407095MPILNXJBRUVNHX-UHFFFAOYSA-NDB-142137Ethyl 3-amino-1-cyclopropyl-1H-pyrazole-4-carboxylate3-amino-1-cyclopropyl-1H-pyrazole-4-carboxylic acid ethyl ester950859-91-3
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