2-[3-(1-hydroxyethyl)-2,2-dimethylcyclobutyl]acetic acid
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![2-[3-(1-hydroxyethyl)-2,2-dimethylcyclobutyl]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/980f5e55db89421089e28e4fcf257eff.png "2-[3-(1-hydroxyethyl)-2,2-dimethylcyclobutyl]acetic acid")
2-[3-(1-hydroxyethyl)-2,2-dimethylcyclobutyl]acetic acid
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CAS No:
473-71-2
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Formula:
C10H18O3
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Chemical Name:
2-[3-(1-hydroxyethyl)-2,2-dimethylcyclobutyl]acetic acid
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Synonyms:
cis(And trans)-Pinolic acid;473-71-2;[3-(1-hydroxyethyl)-2,2-dimethylcyclobutyl]acetic acid;(+/-)-PINOLIC ACID;DTXSID10280432;NSC16787;NSC45644;NSC-16787;NSC-45644;NSC124137;AKOS024323368;MCULE-8902130861;NSC-124137;PINOLIC ACID,(CIS + TRANS MIXT.);2-(3-(1-Hydroxyethyl)-2,2-dimethylcyclobutyl)acetic acid
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CAS No:
2-[3-(1-hydroxyethyl)-2,2-dimethylcyclobutyl]acetic acid Basic Attributes
186.25 g/mol
186.125594432 g/mol
124137|45644|16787
DTXSID10280432
Safety Information
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:186.25
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:186.125594432
Monoisotopic Mass:186.125594432
Topological Polar Surface Area:57.5
Heavy Atom Count:13
Complexity:210
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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