(S)-2-Phenylbutyric acid
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(S)-2-Phenylbutyric acid
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CAS No:
4286-15-1
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Formula:
C10H12O2
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Chemical Name:
(S)-2-Phenylbutyric acid
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Synonyms:
Benzeneacetic acid,α-ethyl-,(αS)-;Butyric acid,2-phenyl-,(S)-(+)-;Benzeneacetic acid,α-ethyl-,(S)-;(αS)-α-Ethylbenzeneacetic acid;(+)-2-Phenylbutanoic acid;(S)-(+)-2-Phenylbutanoic acid;(+)-2-Phenylbutyric acid;(+)-α-Phenylbutyric acid;(S)-2-Phenylbutanoic acid;(S)-(+)-2-Phenylbutyric acid;(S)-2-Phenylbutyric acid;(S)-α-Ethylbenzeneacetic acid;(+)-(S)-2-Phenylbutyric acid;(2S)-2-Phenylbutyric acid;(2S)-2-Phenylbutanoic acid;(S)-α-Ethylphenylacetic acid;(2S)-2-Phenylbutanoic acid
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CAS No:
Safety Information
NONH for all modes of transport
3
R22;R36/38
S26-S36/37/39
Xn: Harmful;
P264, P270, P301+P312, P330, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, and P501|Aggregated GHS information provided by 44 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:164.20
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:164.083729621
Monoisotopic Mass:164.083729621
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:148
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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