4-(3-BUTENYL)BENZOIC ACID
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4-(3-BUTENYL)BENZOIC ACID
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CAS No:
15451-35-1
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Formula:
C11H12O2
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Chemical Name:
4-(3-BUTENYL)BENZOIC ACID
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Synonyms:
4-(3-BUTENYL)BENZOIC ACID;4-(3-butenyl)-benzoic acid;4-(But-3-en-1-yl)benzoic acid;4-(3-buten-1-yl)Benzoic acid;4-but-3-enylbenzoic acid;SCHEMBL3102413;CTK4C8299;DTXSID80597640;ZINC2579567;4836AD
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CAS No:
Safety Information
|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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:176.21
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:176.083729621
Monoisotopic Mass:176.083729621
Topological Polar Surface Area:37.3
Heavy Atom Count:13
Complexity:179
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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