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ethyl 3-hydroxy-5-methylhex-2-enoate

ethyl 3-hydroxy-5-methylhex-2-enoate

CAS: 34036-16-3

Formula: C9H16O3

SMILES: CCOC(=O)C=C(O)CC(C)C

IUPAC: ethyl 3-hydroxy-5-methylhex-2-enoate

InChI: InChI=1S/C9H16O3/c1-4-12-9(11)6-8(10)5-7(2)3/h6-7,10H,4-5H2,1-3H3

Composition: C (62.77%), H (9.36%), O (27.87%)

Molar Mass: 172.224

Atom Count: 28

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 172.109944375
Formal Charge 0
FSP3 0.67
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NFSUPHZPROFWQS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.28
Topological Polar Surface Area 46.53
Polarizability 18.46
Ring Count 0
Rotatable Bond Count 5

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96% <2 Days 34036-16-3 $87.40-$1,127.00$87.40$98.90$109.25$339.25$1,127.00
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