CC(C)(CCCN=C=O)CN=C=O
CAS: 93859-12-2
名称: 1,5-diisocyanato-2,2-dimethylpentane
SMILES: CC(C)(CCCN=C=O)CN=C=O

Molecular Processing

Molecular formula
C9H14N2O2
Molecular weight
182.22
Exact mass
182.1055
XLogP
1.46
TPSA
58.86
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
13
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
48.99

Supplementary Information

InChIKey: OUJCKESIGPLCRN-UHFFFAOYSA-N
同義語
2,2-Dimethylpentane-1,5-diyl diisocyanate1,5-diisocyanato-2,2-dimethylpentane93859-12-2DTXSID30917394RefChem:1053444DTXCID601346354299-348-6EINECS 299-348-6SCHEMBL197341NS00064122
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