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Home > Nitro Compounds > 42139-37-7
42139-37-7 | 4-ISOPROPYL-OMEGA-NITROSTYRENE
CAS No: 42139-37-7 Catalog No: AG003LLL MDL No:MFCD00085100
Product Description
Catalog Number:
AG003LLL
Chemical Name:
4-ISOPROPYL-OMEGA-NITROSTYRENE
CAS Number:
42139-37-7
MDL Number:
MFCD00085100
IUPAC Name:
1-[(E)-2-nitroethenyl]-4-propan-2-ylbenzene
InChI:
InChI=1S/C11H13NO2/c1-9(2)11-5-3-10(4-6-11)7-8-12(13)14/h3-9H,1-2H3/b8-7+
InChI Key:
PLOZMGIWCWVROY-BQYQJAHWSA-N
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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