3-Mercaptobenzoic acid
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3-Mercaptobenzoic acid
structure -
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CAS No:
4869-59-4
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Formula:
C7H6O2S
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Chemical Name:
3-Mercaptobenzoic acid
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Synonyms:
Benzoic acid,3-mercapto-;Benzoic acid,m-mercapto-;3-Mercaptobenzoic acid;m-Mercaptobenzoic acid;NSC 32021;3-Sulfanylbenzoic acid
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CAS No:
Characteristics
38.3
2.3
1.3±0.1 g/cm3
146-147 °C
149.0±23.2 °C
1.642
-20°C Freezer, Under Inert Atmosphere
Safety Information
Ⅲ
IRRITANT
3261
3
37/38-41-36/37/38
26-36/37/39-36
Xi
Sensitive to Oxidation in Air
P261-P280-P305 + P351 + P338
H315-H318-H335
|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
3-Mercaptobenzoic acid Use and Manufacturing
An aromatic thiol compound reducing agent hair cosmetic
Computed Properties
Molecular Weight:154.19
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:154.00885060
Monoisotopic Mass:154.00885060
Topological Polar Surface Area:38.3
Heavy Atom Count:10
Complexity:136
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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