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phenyl(2H-tetrazol-5-yl)methanone

phenyl(2H-tetrazol-5-yl)methanone structure

CAS No:
14506-41-3
Formula:
C8H6N4O
Chemical Name:
phenyl(2H-tetrazol-5-yl)methanone
Synonyms:
phenyl(2h-tetrazol-5-yl)methanone;14506-41-3;5-benzoyl-2H-1,2,3,4-tetrazole;phenyl-2H-tetrazol-5-yl-methanone;benzoyl-tetrazole;5-benzoyltetrazole;Methanone,phenyl-2H-tetrazol-5-yl-;NSC139199;5-Benzoyl-1H-tetrazole;SCHEMBL1694534;SCHEMBL20817266;DTXSID50932483;ZINC5602261;AKOS024356972;MCULE-7051271363;NSC-139199;DS-011382;2H-1,2,3,4-tetraazol-5-yl phenyl ketone;ST50985101;Z2681277166

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phenyl(2H-tetrazol-5-yl)methanone Basic Attributes

Molecular Weight：

174.16 g/mol

Exact Mass：

174.05416083 g/mol

NSC Number：

139199

Characteristics

PSA：

71.5 Å²

Safety Information

GHS Classification：

|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:174.16
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:174.05416083
Monoisotopic Mass:174.05416083
Topological Polar Surface Area:71.5
Heavy Atom Count:13
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of phenyl(2H-tetrazol-5-yl)methanone

Basic Attributes
Characteristics
Safety Information
Computed Properties

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