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Home > Nitro Compounds > 374588-08-6
374588-08-6 | 1-(but-3-en-1-yloxy)-3-nitrobenzene
CAS No: 374588-08-6 Catalog No: AG01A6JI MDL No:MFCD25970322
Product Description
Catalog Number:
AG01A6JI
Chemical Name:
1-(but-3-en-1-yloxy)-3-nitrobenzene
CAS Number:
374588-08-6
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
MDL Number:
MFCD25970322
IUPAC Name:
1-but-3-enoxy-3-nitrobenzene
InChI:
InChI=1S/C10H11NO3/c1-2-3-7-14-10-6-4-5-9(8-10)11(12)13/h2,4-6,8H,1,3,7H2
InChI Key:
BSFHJJPDYDVFDV-UHFFFAOYSA-N
SMILES:
C=CCCOc1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.202g/mol
Monoisotopic Mass:
193.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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