4-Phenylsemicarbazide

C₇H₉N₃OCAS 537-47-3151.17 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₇H₉N₃O
Molar mass: 151.17 g/mol
Exact mass: 151.0746 Da
Melting point: 128 °C
logP: 0.70Crippen estimate
Polar surface area: 70.6 Å²
H-bond donors / acceptors: 3 / 2
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation50% of notifiers
H319 Causes serious eye irritation50% of notifiers
H332 Harmful if inhaled50% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

537-47-3

SMILES

NNC(O)=Nc1ccccc1

InChIKey

MOCKWYUCPREFCZ-UHFFFAOYSA-N

InChI

InChI=1S/C7H9N3O/c8-10-7(11)9-6-4-2-1-3-5-6/h1-5H,8H2,(H2,9,10,11)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

12 names

Hydrazinecarboxamide, N-phenyl-
Semicarbazide, 4-phenyl-
N-Phenylhydrazinecarboxamide
Anilinoformylhydrazine
1-Amino-3-phenylurea
Hydrazinecarboxanilide
Phenylsemicarbazide
Anilinocarbonylhydrazine
Phenylaminocarbonylhydrazine
NSC 231527
N-Phenylsemicarbazide
3-Amino-1-phenylurea

Reactions

4-PHENYLSEMICARBAZIDE (Semicarbazide, 4-phenyl-)product

Work with 4-Phenylsemicarbazide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,3-Diphenylurea102-07-859 % similar 4-Phenylthiosemicarbazide5351-69-957 % similar Thidiazuron51707-55-245 % similar 2-Amino-N-phenylbenzamide4424-17-344 % similar Acetanilide103-84-443 % similar Benzanilide93-98-143 % similar Carbohydrazide497-18-743 % similar N,N′,N′′-Triphenylguanidine101-01-942 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-Phenylsemicarbazide103-03-7 N-(6-Aminopyridin-2-yl)acetamide1075-62-3 M-Aminobenzhydrazide14062-34-1 2-Aminobenzohydrazide1904-58-1 4-Aminobenzoic acid hydrazide5351-17-7

Elsewhere

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