C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O
CAS: 101-68-8
名称: 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene
SMILES: C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O

Molecular Processing

Molecular formula
C15H10N2O2
Molecular weight
250.26
Exact mass
250.0742
XLogP
3.21
TPSA
58.86
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
71.25

Supplementary Information

InChIKey: UPMLOUAZCHDJJD-UHFFFAOYSA-N
同義語
101-68-84,4'-Diphenylmethane diisocyanateDiphenylmethane diisocyanateBis(4-isocyanatophenyl)methane4,4'-Methylenebis(phenyl isocyanate)IsonateDesmodur 44p,p'-Diphenylmethane diisocyanate1,1'-Methylenebis(4-isocyanatobenzene)Methylbisphenyl isocyanate4,4'-Methylenediphenyl diisocyanate4,4'-DiisocyanatodiphenylmethaneMethylene bisphenyl isocyanatediphenylmethane-4,4'-diisocyanateCaradate 30Nacconate 300Isonate 125MBis(p-isocyanatophenyl)methaneDiphenylmethyl diisocyanateIsonate 125 MFRubinate 44Bis(1,4-isocyanatophenyl)methaneMethylenebis(4-phenyl isocyanate)Hylene M50Diphenylmethan-4,4'-diisocyanatMethylenebis(4-isocyanatobenzene)Methylenebis(p-phenyl isocyanate)Benzene, 1,1'-methylenebis[4-isocyanato-Diphenyl methane diisocyanate4,4'-Methylenediphenyl isocyanate
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