3-chloro-4-hydroxybenzohydrazide

C7H7ClN2O2 — CID 10954268

IUPAC3-chloro-4-hydroxybenzohydrazide
SMILESNNC(=O)c1ccc(O)c(Cl)c1
InChIInChI=1S/C7H7ClN2O2/c8-5-3-4(7(12)10-9)1-2-6(5)11/h1-3,11H,9H2,(H,10,12)
InChIKeyUGUNVMQWBRYTIE-UHFFFAOYSA-N
MW186.60 g/mol
LogP0.65
Rot. Bonds1

About 3-chloro-4-hydroxybenzohydrazide

3-chloro-4-hydroxybenzohydrazide (PubChem CID 10954268) has the molecular formula C7H7ClN2O2 and a molecular weight of 186.60 g/mol. Its IUPAC name is 3-chloro-4-hydroxybenzohydrazide.

Molecular Properties

Compound Name3-chloro-4-hydroxybenzohydrazide
PubChem CID10954268
Molecular FormulaC7H7ClN2O2
Molecular Weight186.60 g/mol
Exact Mass186.02
IUPAC Name3-chloro-4-hydroxybenzohydrazide
SMILESNNC(=O)c1ccc(O)c(Cl)c1
InChIInChI=1S/C7H7ClN2O2/c8-5-3-4(7(12)10-9)1-2-6(5)11/h1-3,11H,9H2,(H,10,12)
InChIKeyUGUNVMQWBRYTIE-UHFFFAOYSA-N
XLogP0.65
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.60
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-hydroxybenzene-1,3-dicarbohydrazide
CID 13149470
3-chloro-4-hydroxybenzamide
CID 22932347
N-(3-amino-3-sulfanylidenepropyl)-3-chloro-4-hydroxybenzamide
CID 62666300
3-amino-4-hydroxybenzohydrazide;dihydrochloride
CID 22411252
3-chloro-N-(3-chloropropyl)-4-hydroxybenzamide
CID 114293588
N-(4-bromobutyl)-3-chloro-4-hydroxybenzamide
CID 106845855
N-[(4-carbamothioylphenyl)methyl]-3-chloro-4-hydroxybenzamide
CID 62309633
3-chloro-4-hydroxy-N-(4-iodobutyl)benzamide
CID 106846289
methyl 2-[(3-chloro-4-hydroxybenzoyl)amino]propanoate
CID 60654193
3-chloro-N-(4-chloro-3-hydroxyphenyl)-4-hydroxybenzamide
CID 64788669
methyl 2-chloro-4-(hydrazinecarbonyl)benzoate
CID 67050317
3-chloro-N-(2,2-difluoro-3-hydroxypropyl)-4-hydroxybenzamide
CID 113472136

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-hydroxybenzohydrazide?
The IUPAC name of 3-chloro-4-hydroxybenzohydrazide (CID 10954268) is 3-chloro-4-hydroxybenzohydrazide.
What is the SMILES notation for 3-chloro-4-hydroxybenzohydrazide?
The canonical SMILES for 3-chloro-4-hydroxybenzohydrazide is NNC(=O)c1ccc(O)c(Cl)c1.
What is the InChIKey of 3-chloro-4-hydroxybenzohydrazide?
The InChIKey is UGUNVMQWBRYTIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2O2/c8-5-3-4(7(12)10-9)1-2-6(5)11/h1-3,11H,9H2,(H,10,12).
What are the key properties of 3-chloro-4-hydroxybenzohydrazide?
3-chloro-4-hydroxybenzohydrazide has a molecular weight of 186.60 g/mol, XLogP of 0.65, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-hydroxybenzohydrazide is sourced from PubChem (CID 10954268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).