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Hex-2-Enoic Acid
[CAS 1191-04-4]

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Identification
Name Hex-2-Enoic Acid
Synonyms Hex-2-Enoic Acid; W316903_Aldrich; (Z)-2-Hexenoic Acid
Molecular Formula C6H10O2
Molecular Weight 114.14
CAS Registry Number 1191-04-4
EINECS 214-727-8
SMILES C(/C=C/C(O)=O)CC
InChI 1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+
InChIKey NIONDZDPPYHYKY-SNAWJCMRSA-N
Properties
Density 0.965 (Expl.)
1.0±0.1g/cm3 (Cal.)
Melting point 30-35°C (Expl.)
Boiling point 216.499°C at 760 mmHg (Cal.)
217°C (Expl.)
Flash point 32°C (Expl.)
115.4±9.6°C (Cal.)
Refractive index 1.4385 (Expl.)
Safety Data
Safety Code S26;S36/37/39;S45  Details
Risk Code R34  Details
Hazard Symbol symbol  C  Details
Transport Information UN3261
Safety Description DANGER: CORROSIVE, burns skin and eyes
References
(1) Yasuyuki Yoshitake, Junichi Misaka, Masaki Abe, Masatoshi Yamasaki, Masashi Eto and Kazunobu Harano. Carboxylic acid clathrate hosts of Diels–Alder adducts of phencyclone and 2-alkenoic acids. Role of bidentate C–H?O hydrogen bonds between the phenanthrene and carbonyl groups in host–host net works, Org. Biomol. Chem., 2003, 1, 1240.
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