1,2,3-THIADIAZOLE-4-CARBOXYLICACID
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1,2,3-THIADIAZOLE-4-CARBOXYLICACID
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CAS No:
4100-13-4
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Formula:
C3H2N2O2S
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Chemical Name:
1,2,3-THIADIAZOLE-4-CARBOXYLICACID
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Synonyms:
1,2,3-thiadiazole-4-carboxylic acid;123-T-4CA;MFCD00052099;[1,2,3]Thiadiazole-4-carboxylic acid;thiadiazole-4-carboxylic acid;NSC521674;SCHEMBL243344;ACMC-20a403;CHEMBL247337
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CAS No:
1,2,3-THIADIAZOLE-4-CARBOXYLICACID Basic Attributes
130.13
129.98400
521674
DTXSID50325896
2934999090
Characteristics
91.3
0.3
yellow solid.
1.67 g/cm3
224 °C
322.3°C at 760 mmHg
148.7ºC
Slightly soluble in water.
Safety Information
R36/37/38
S26-S36/37/39
Xi:Irritant;
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|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|Aggregated GHS information provided by 7 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:130.13
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:129.98369848
Monoisotopic Mass:129.98369848
Topological Polar Surface Area:91.3
Heavy Atom Count:8
Complexity:108
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
1,2,3-THIADIAZOLE-4-CARBOXYLICACID
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