3-Pentenoic acid
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3-Pentenoic acid
structure -
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CAS No:
5204-64-8
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Formula:
C5H8O2
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Chemical Name:
3-Pentenoic acid
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Synonyms:
3-Pentenoic acid;Δ3-Pentenoic acid;4-Methyl-3-butenoic acid
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CAS No:
Characteristics
37.30000
1.03720
1.008g/cm3
20.44°C (estimate)
85-92 °C @ Press: 10 Torr
89.5ºC
n20/D 1.435
Safety Information
UN 3265 8/PG 3
3
34
26-36/37/39-45
C
P280-P305 + P351 + P338-P310
H314
|Danger|H290 (100%): May be corrosive to metals [Warning Corrosive to Metals]|P234, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P390, P404, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:100.12
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:100.052429494
Monoisotopic Mass:100.052429494
Topological Polar Surface Area:37.3
Heavy Atom Count:7
Complexity:84.1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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