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26404-71-7 | 4-Hexen-3-ol, 6-(diethylamino)-3-methyl-
CAS No: 26404-71-7 Catalog No: AG002T2G MDL No:
Product Description
Catalog Number:
AG002T2G
Chemical Name:
4-Hexen-3-ol, 6-(diethylamino)-3-methyl-
CAS Number:
26404-71-7
Molecular Formula:
C11H23NO
Molecular Weight:
185.3064
IUPAC Name:
6-(diethylamino)-3-methylhex-4-en-3-ol
InChI:
InChI=1S/C11H23NO/c1-5-11(4,13)9-8-10-12(6-2)7-3/h8-9,13H,5-7,10H2,1-4H3
InChI Key:
ADCNSPGLALWFEK-UHFFFAOYSA-N
SMILES:
CCN(CC=CC(CC)(O)C)CC
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.178g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.311g/mol
Monoisotopic Mass:
185.178g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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