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84625-53-6 | 6,8-Nonadien-3-one,2,4,4-trimethyl-, oxime
CAS No: 84625-53-6 Catalog No: AG004Q2Y MDL No:
Product Description
Catalog Number:
AG004Q2Y
Chemical Name:
6,8-Nonadien-3-one,2,4,4-trimethyl-, oxime
CAS Number:
84625-53-6
Molecular Formula:
C12H21NO
Molecular Weight:
195.3012
IUPAC Name:
(NZ)-N-[(6E)-2,4,4-trimethylnona-6,8-dien-3-ylidene]hydroxylamine
InChI:
InChI=1S/C12H21NO/c1-6-7-8-9-12(4,5)11(13-14)10(2)3/h6-8,10,14H,1,9H2,2-5H3/b8-7+,13-11-
InChI Key:
JZVFMABEZCKLSU-ZXAHDXGASA-N
SMILES:
C=CC=CCC(C(=NO)C(C)C)(C)C
EC Number:
283-424-0
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
195.162g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.306g/mol
Monoisotopic Mass:
195.162g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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