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Home > Nitro Compounds > 2008-62-0
2008-62-0 | 1-ISOCYANO-2-METHOXY-4-NITROBENZENE
CAS No: 2008-62-0 Catalog No: AG00I3QW MDL No:MFCD01937388
Product Description
Catalog Number:
AG00I3QW
Chemical Name:
1-ISOCYANO-2-METHOXY-4-NITROBENZENE
CAS Number:
2008-62-0
MDL Number:
MFCD01937388
IUPAC Name:
1-isocyano-2-methoxy-4-nitrobenzene
InChI:
InChI=1S/C8H6N2O3/c1-9-7-4-3-6(10(11)12)5-8(7)13-2/h3-5H,2H3
InChI Key:
VDKINYWOFNMGRL-UHFFFAOYSA-N
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.038g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.147g/mol
Monoisotopic Mass:
178.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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