4-(4-BROMO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID
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4-(4-BROMO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID
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CAS No:
387344-96-9
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Formula:
C11H9BrN2O2
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Chemical Name:
4-(4-BROMO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID
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Synonyms:
ART-CHEM-BB B000159;AKOS PAO-0084;AKOS B000159;4-((4-BROMO-1H-PYRAZOL-1-YL)METHYL)BENZOIC ACID;4-(4-BROMO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID;benzoic acid, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-;4-[(4-bromo-1-pyrazolyl)methyl]benzoic acid;4-[(4-bromo-2H-pyrazol-1-ium-1-yl)methyl]benzoate
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CAS No:
4-(4-BROMO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID Basic Attributes
281.11
279.98500
DTXSID20342898
2933199090
Safety Information
IRRITANT
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
Computed Properties
Molecular Weight:281.10
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:279.98474
Monoisotopic Mass:279.98474
Topological Polar Surface Area:55.1
Heavy Atom Count:16
Complexity:254
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-(4-BROMO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID
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