3-(hydrazinylmethyl)-2-iodophenol;hydrochloride

C7H10ClIN2O — CID 135395452

IUPAC3-(hydrazinylmethyl)-2-iodophenol;hydrochloride
SMILESCl.NNCc1cccc(O)c1I
InChIInChI=1S/C7H9IN2O.ClH/c8-7-5(4-10-9)2-1-3-6(7)11;/h1-3,10-11H,4,9H2;1H
InChIKeyAQCMVDYFOCXRLK-UHFFFAOYSA-N
MW300.53 g/mol
LogP1.38
Rot. Bonds2

About 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride

3-(hydrazinylmethyl)-2-iodophenol;hydrochloride (PubChem CID 135395452) has the molecular formula C7H10ClIN2O and a molecular weight of 300.53 g/mol. Its IUPAC name is 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride.

Molecular Properties

Compound Name3-(hydrazinylmethyl)-2-iodophenol;hydrochloride
PubChem CID135395452
Molecular FormulaC7H10ClIN2O
Molecular Weight300.53 g/mol
Exact Mass299.95
IUPAC Name3-(hydrazinylmethyl)-2-iodophenol;hydrochloride
SMILESCl.NNCc1cccc(O)c1I
InChIInChI=1S/C7H9IN2O.ClH/c8-7-5(4-10-9)2-1-3-6(7)11;/h1-3,10-11H,4,9H2;1H
InChIKeyAQCMVDYFOCXRLK-UHFFFAOYSA-N
XLogP1.38
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.53
LogP ≤ 51.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(3-fluoro-2-iodophenyl)methylhydrazine
CID 135394130
naphthalen-1-ylmethylhydrazine;hydrochloride
CID 71656108
3-[(dimethylamino)methyl]-2-iodophenol
CID 135394008
(2,3-dibromophenyl)methylhydrazine;hydrochloride
CID 135397409
5-fluoro-2-(hydrazinylmethyl)phenol;hydrochloride
CID 154729993
(2-methylphenyl)methylhydrazine;hydrochloride
CID 42940672
2-(hydrazinylmethyl)aniline
CID 126609519
4-(hydrazinylmethyl)benzene-1,2,3-triol;methanol
CID 90472349
[3-(bromomethyl)-2-iodophenyl]hydrazine
CID 130781602
(2-chloro-3-fluorophenyl)methylhydrazine
CID 81453607
4-[(azanyl(15N)amino)methyl]benzene-1,2,3-triol;oxalic acid
CID 175673177
ethane;(2-fluorophenyl)methylhydrazine
CID 142817687

Frequently Asked Questions

What is the IUPAC name of 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride?
The IUPAC name of 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride (CID 135395452) is 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride.
What is the SMILES notation for 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride?
The canonical SMILES for 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride is Cl.NNCc1cccc(O)c1I.
What is the InChIKey of 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride?
The InChIKey is AQCMVDYFOCXRLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9IN2O.ClH/c8-7-5(4-10-9)2-1-3-6(7)11;/h1-3,10-11H,4,9H2;1H.
What are the key properties of 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride?
3-(hydrazinylmethyl)-2-iodophenol;hydrochloride has a molecular weight of 300.53 g/mol, XLogP of 1.38, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydrazinylmethyl)-2-iodophenol;hydrochloride is sourced from PubChem (CID 135395452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).