benzyl chlorite

C7H7ClO2 — CID 139715703

IUPACbenzyl chlorite
SMILES[O-][Cl+]OCc1ccccc1
InChIInChI=1S/C7H7ClO2/c9-8-10-6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKeyOMSVPNHWPDREDI-UHFFFAOYSA-N
MW158.58 g/mol
LogP0.48
Rot. Bonds3

About benzyl chlorite

benzyl chlorite (PubChem CID 139715703) has the molecular formula C7H7ClO2 and a molecular weight of 158.58 g/mol. Its IUPAC name is benzyl chlorite.

Molecular Properties

Compound Namebenzyl chlorite
PubChem CID139715703
Molecular FormulaC7H7ClO2
Molecular Weight158.58 g/mol
Exact Mass158.01
IUPAC Namebenzyl chlorite
SMILES[O-][Cl+]OCc1ccccc1
InChIInChI=1S/C7H7ClO2/c9-8-10-6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKeyOMSVPNHWPDREDI-UHFFFAOYSA-N
XLogP0.48
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.58
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze benzyl chlorite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Benzyl Alcohol
CID 244
Benzyl ethyl ether
CID 10873
Benzyl chloroformate
CID 10387
Benzyl butyl ether
CID 61134
Benzyl methyl ether
CID 10869
Benzyloxyamine hydrochloride
CID 102312
1,4-Bis(Methoxymethyl)Benzene
CID 81239
O-Benzylhydroxylamine
CID 102313
Allyl benzyl ether
CID 84542
3-Iodobenzyl alcohol
CID 42300
1-Hydroxy-2,1-benzoxaborole
CID 403788
2,3-Difluorobenzyl Alcohol
CID 447153

Frequently Asked Questions

What is the IUPAC name of benzyl chlorite?
The IUPAC name of benzyl chlorite (CID 139715703) is benzyl chlorite.
What is the SMILES notation for benzyl chlorite?
The canonical SMILES for benzyl chlorite is [O-][Cl+]OCc1ccccc1.
What is the InChIKey of benzyl chlorite?
The InChIKey is OMSVPNHWPDREDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClO2/c9-8-10-6-7-4-2-1-3-5-7/h1-5H,6H2.
What are the key properties of benzyl chlorite?
benzyl chlorite has a molecular weight of 158.58 g/mol, XLogP of 0.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl chlorite is sourced from PubChem (CID 139715703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).