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4-Chlorobenzamidrazone

HCID 2806641
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Basic information

CAS
36286-75-6
Standard SMILES
NN=C(N)c1ccc(Cl)cc1
InChIKey
YDLIPQYFLCGAII-UHFFFAOYSA-N
Molecular formula
C7H8ClN3
Average molar mass
169.61 g/mol
Monoisotopic mass
169.040675

Names & identifiers

Preferred name
4-Chlorobenzamidrazone
IUPAC
N'-amino-4-chlorobenzenecarboximidamide
English name
4-CHLORO-BENZENECARBOXIMIDIC ACID, HYDRAZIDE
Molecular formula
C7H8ClN3
Molecular weight
169.61

Names & synonyms

4-chlorobenzamidrazone36286-75-6DTXSID80384512RefChem:292091DTXCID50335536N'-amino-4-chlorobenzenecarboximidamide4-Chloro-benzenecarboximidic acid,hydrazide4-CHLORO-BENZENECARBOXIMIDIC ACID, HYDRAZIDESCHEMBL2953497YDLIPQYFLCGAII-UHFFFAOYSA-N4-Chlorobenzene-1-carbohydrazonamide4-chloro-benzenecarboximidic hydrazide
Show more names
Benzenecarboximidic acid, 4-chloro-, hydrazide
AKOS010598294

Database identifiers

CAS
36286-75-6
PubChem CID
2806641
DTXSID
DTXSID80384512

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
64.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
150

Physicochemical properties

Melting point
89 · 89-92 °C
Boiling point
262.9 · 262.9±42.0 °C(Predicted)
Density
1.36 · 1.36±0.1 g/cm3(Predicted)
pka
8.09 · 8.09±0.50(Predicted)

Chemistry & industry

Upstream & downstream products

Downstream products

ETHYL 3-(4-CHLOROPHENYL)-5-HYDROXY-1,2,4-TRIAZINE-6-CARBOXYLATE

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Compound notes

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