1,2-Heptanediol, 1-acetate
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1,2-Heptanediol, 1-acetate
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CAS No:
39846-66-7
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Formula:
C9H18O3
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Chemical Name:
1,2-Heptanediol, 1-acetate
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Synonyms:
1,2-Heptanediol,1-acetate;1-Acetoxy-2-hydroxyheptane
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CAS No:
Computed Properties
Molecular Weight:174.24
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:174.125594432
Monoisotopic Mass:174.125594432
Topological Polar Surface Area:46.5
Heavy Atom Count:12
Complexity:123
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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