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Home > Nitro Compounds > 893763-95-6
893763-95-6 | 2-[(1E)-2-nitroprop-1-en-1-yl]dibenzo[b,d]furan
CAS No: 893763-95-6 Catalog No: AG00JH35 MDL No:MFCD07658425
Product Description
Catalog Number:
AG00JH35
Chemical Name:
2-[(1E)-2-nitroprop-1-en-1-yl]dibenzo[b,d]furan
CAS Number:
893763-95-6
Molecular Formula:
C15H11NO3
Molecular Weight:
253.2527
MDL Number:
MFCD07658425
IUPAC Name:
2-[(E)-2-nitroprop-1-enyl]dibenzofuran
InChI:
InChI=1S/C15H11NO3/c1-10(16(17)18)8-11-6-7-15-13(9-11)12-4-2-3-5-14(12)19-15/h2-9H,1H3/b10-8+
InChI Key:
HJZAYNORFNQLDP-CSKARUKUSA-N
SMILES:
[O-][N+](=O)/C(=C/c1ccc2c(c1)c1ccccc1o2)/C
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
253.074g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.257g/mol
Monoisotopic Mass:
253.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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