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Home > Nitro Compounds > 147671-61-2
147671-61-2 | 3-Decene, 2-ethoxy-1-nitro-, (E)- (9CI)
CAS No: 147671-61-2 Catalog No: AG001F2M MDL No:
Product Description
Catalog Number:
AG001F2M
Chemical Name:
3-Decene, 2-ethoxy-1-nitro-, (E)- (9CI)
CAS Number:
147671-61-2
Molecular Formula:
C12H23NO3
Molecular Weight:
229.3159
IUPAC Name:
2-ethoxy-1-nitrodec-3-ene
InChI:
InChI=1S/C12H23NO3/c1-3-5-6-7-8-9-10-12(16-4-2)11-13(14)15/h9-10,12H,3-8,11H2,1-2H3
InChI Key:
ARGQEJNOGLXNPD-UHFFFAOYSA-N
SMILES:
CCCCCC/C=C/C(C[N+](=O)[O-])OCC
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.168g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.32g/mol
Monoisotopic Mass:
229.168g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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