Pinonic acid
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Pinonic acid
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CAS No:
473-72-3
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Formula:
C10H16O3
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Chemical Name:
Pinonic acid
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Synonyms:
Cyclobutaneacetic acid,3-acetyl-2,2-dimethyl-;3-Acetyl-2,2-dimethylcyclobutaneacetic acid;Pinonic acid;NSC 29469;NSC 46248;NSC 96748;2-(3-Acetyl-2,2-dimethylcyclobutyl)acetic acid;17160-30-4
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CAS No:
Characteristics
54.37000
1.71240
1.46501 g/cm3 @ Temp: 15 °C
98-99 °C
189-195 °C @ Press: 18 Torr
152.6ºC
1.48
3.686g/L(0 ºC)
Safety Information
R36/37/38
S26-S37/39
Xi:Irritant;
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:184.23
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:184.109944368
Monoisotopic Mass:184.109944368
Topological Polar Surface Area:54.4
Heavy Atom Count:13
Complexity:243
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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