4-methylpentyl benzoate
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4-methylpentyl benzoate
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CAS No:
5444-77-9
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Formula:
C13H18O2
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Chemical Name:
4-methylpentyl benzoate
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Synonyms:
4-methylpentyl benzoate;5444-77-9;Q63395319;isohexyl benzoate;NSC19157;Benzoic acid, isohexyl ester;SCHEMBL14937504;DTXSID80280949;Benzoic acid 4-methylpentyl ester;ZINC1562395;NSC-19157
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CAS No:
Computed Properties
Molecular Weight:206.28
XLogP3:4.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:206.130679813
Monoisotopic Mass:206.130679813
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Complexity:181
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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