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6065-12-9 | 4-NITRO-3-HEPTENE
CAS No: 6065-12-9 Catalog No: AG00F3CB MDL No:
Product Description
Catalog Number:
AG00F3CB
Chemical Name:
4-NITRO-3-HEPTENE
CAS Number:
6065-12-9
IUPAC Name:
(Z)-4-nitrohept-3-ene
InChI:
InChI=1S/C7H13NO2/c1-3-5-7(6-4-2)8(9)10/h5H,3-4,6H2,1-2H3/b7-5-
InChI Key:
VCYHLUUGOMPZTB-ALCCZGGFSA-N
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
143.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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