3-BENZOIMIDAZOL-1-YL-PROPIONIC ACID
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3-BENZOIMIDAZOL-1-YL-PROPIONIC ACID
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CAS No:
14840-18-7
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Formula:
C10H10N2O2
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Chemical Name:
3-BENZOIMIDAZOL-1-YL-PROPIONIC ACID
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Synonyms:
3-(1H-Benzo[d]imidazol-1-yl);TIMTEC-BB SBB010152;3-(BENZOIMIDAZOLE-1-YL)-PROPIONIC ACID;3-BENZOIMIDAZOL-1-YL-PROPIONIC ACID;AKOS BBS-00002536;AKOS MSC-0006;3-(1H-BENZIMIDAZOL-1-YL)PROPANOIC ACID;CHEMBRDG-BB 4001991
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CAS No:
Characteristics
55.1
0.9
1.29±0.1 g/cm3(Predicted)
212-214 °C(Solv: methanol (67-56-1); ethyl ether (60-29-7))
415.5±47.0 °C(Predicted)
205.1ºC
1.631
1.2E-07mmHg at 25°C
Safety Information
IRRITANT
22
Xi,Xn
Irritant
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, 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:190.20
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:190.074227566
Monoisotopic Mass:190.074227566
Topological Polar Surface Area:55.1
Heavy Atom Count:14
Complexity:220
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-BENZOIMIDAZOL-1-YL-PROPIONIC ACID
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