3-(3-hydroxyprop-1-ynyl)benzoic acid
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3-(3-hydroxyprop-1-ynyl)benzoic acid
structure -
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CAS No:
132545-15-4
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Formula:
C10H8O3
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Chemical Name:
3-(3-hydroxyprop-1-ynyl)benzoic acid
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Synonyms:
OR7435;
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CAS No:
3-(3-hydroxyprop-1-ynyl)benzoic acid Basic Attributes
176.16900
176.047344113
DTXSID00407818
2918199090
Safety Information
Xi
|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:176.17
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:176.047344113
Monoisotopic Mass:176.047344113
Topological Polar Surface Area:57.5
Heavy Atom Count:13
Complexity:245
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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