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Home > Other Heterocycles > 74091-64-8
74091-64-8 | Bicyclo[2.2.1]heptane,2,5(or 2,6)-bis(isocyanatomethyl)-
CAS No: 74091-64-8 Catalog No: AG005HKH MDL No:
Product Description
Catalog Number:
AG005HKH
Chemical Name:
Bicyclo[2.2.1]heptane,2,5(or 2,6)-bis(isocyanatomethyl)-
CAS Number:
74091-64-8
Molecular Formula:
C9H10N2O2--
Molecular Weight:
178.1879
IUPAC Name:
bicyclo[2.2.1]hept-2-ene;diisocyanate
InChI:
InChI=1S/C7H10.2CNO/c1-2-7-4-3-6(1)5-7;2*2-1-3/h1-2,6-7H,3-5H2;;/q;2*-1
InChI Key:
KOUFORMGSOSYMV-UHFFFAOYSA-N
SMILES:
C1CC2CC1C=C2.[N-]=C=O.[N-]=C=O
EC Number:
411-280-2
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
-2
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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