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88768-52-9

88768-52-9 | Furan, 2,2'-ethylidenebis[5-isocyanato-

CAS No: 88768-52-9 Catalog No: AG004B8P MDL No:

Product Description

Catalog Number:
AG004B8P
Chemical Name:
Furan, 2,2'-ethylidenebis[5-isocyanato-
CAS Number:
88768-52-9
Molecular Formula:
C12H8N2O4
Molecular Weight:
244.2029
IUPAC Name:
2-isocyanato-5-[1-(5-isocyanatofuran-2-yl)ethyl]furan
InChI:
InChI=1S/C12H8N2O4/c1-8(9-2-4-11(17-9)13-6-15)10-3-5-12(18-10)14-7-16/h2-5,8H,1H3
InChI Key:
BKSUHHVEWHAWLC-UHFFFAOYSA-N
SMILES:
CC(c1ccc(o1)N=C=O)c1ccc(o1)N=C=O

Properties

Complexity:
352  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.048g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.206g/mol
Monoisotopic Mass:
244.048g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
85.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

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