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Home > Nitro Compounds > 1152844-08-0
1152844-08-0 | 2-(azidomethyl)-1-methoxy-4-nitrobenzene
CAS No: 1152844-08-0 Catalog No: AG01A5ZZ MDL No:MFCD11637176
Product Description
Catalog Number:
AG01A5ZZ
Chemical Name:
2-(azidomethyl)-1-methoxy-4-nitrobenzene
CAS Number:
1152844-08-0
Molecular Formula:
C8H8N4O3
Molecular Weight:
208.1741
MDL Number:
MFCD11637176
IUPAC Name:
2-(azidomethyl)-1-methoxy-4-nitrobenzene
InChI:
InChI=1S/C8H8N4O3/c1-15-8-3-2-7(12(13)14)4-6(8)5-10-11-9/h2-4H,5H2,1H3
InChI Key:
KOBPZMRFRJEQOF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(CN=[N+]=[N-])c(cc1)OC
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.06g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.177g/mol
Monoisotopic Mass:
208.06g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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