CC(C)(C)OC(=O)N=C(NC(=O)OC(C)(C)C)c1cc[nH]n1
名称: [N,N′-di(tert-butoxycarbonyl)]amidinopyrazole
SMILES: CC(C)(C)OC(=O)N=C(NC(=O)OC(C)(C)C)c1cc[nH]n1

Molecular Processing

Molecular formula
C14H22N4O4
Molecular weight
310.35
Exact mass
310.1641
XLogP
2.62
TPSA
105.67
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
80.73

Supplementary Information

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