C1CCC2(C1)C(O2)C#N
CAS: 36929-35-8
이름: 1-oxaspiro[2.4]heptane-2-carbonitrile
SMILES: C1CCC2(C1)C(O2)C#N

Molecular Processing

Molecular formula
C7H9NO
Molecular weight
123.15
Exact mass
123.0684
XLogP
1.22
TPSA
36.32
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
31.68

Supplementary Information

InChIKey: GFCYZQVCDGGQOP-UHFFFAOYSA-N
동의어
1-Oxaspiro[2.4]heptane-2-carbonitrile36929-35-8DTXSID003384111-Oxaspiro(2.4)heptane-2-carbonitrileRefChem:232751DTXCID20289496GFCYZQVCDGGQOP-UHFFFAOYSA-NSCHEMBL978499AKOS0062738621-Oxa-spiro[2.4]heptane-2-carbonitrileDB-329009CS-0271645EN300-154940F1915-8800
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