2-chloro-10H-phenoxazine

C12H8ClNO — CID 10632580

IUPAC2-chloro-10H-phenoxazine
SMILESClc1ccc2c(c1)Nc1ccccc1O2
InChIInChI=1S/C12H8ClNO/c13-8-5-6-12-10(7-8)14-9-3-1-2-4-11(9)15-12/h1-7,14H
InChIKeyZLPPJJZCOCPXDE-UHFFFAOYSA-N
MW217.66 g/mol
LogP4.19
Rot. Bonds

About 2-chloro-10H-phenoxazine

2-chloro-10H-phenoxazine (PubChem CID 10632580) has the molecular formula C12H8ClNO and a molecular weight of 217.66 g/mol. Its IUPAC name is 2-chloro-10H-phenoxazine.

Molecular Properties

Compound Name2-chloro-10H-phenoxazine
PubChem CID10632580
Molecular FormulaC12H8ClNO
Molecular Weight217.66 g/mol
Exact Mass217.03
IUPAC Name2-chloro-10H-phenoxazine
SMILESClc1ccc2c(c1)Nc1ccccc1O2
InChIInChI=1S/C12H8ClNO/c13-8-5-6-12-10(7-8)14-9-3-1-2-4-11(9)15-12/h1-7,14H
InChIKeyZLPPJJZCOCPXDE-UHFFFAOYSA-N
XLogP4.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.66
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-10H-phenoxazine?
The IUPAC name of 2-chloro-10H-phenoxazine (CID 10632580) is 2-chloro-10H-phenoxazine.
What is the SMILES notation for 2-chloro-10H-phenoxazine?
The canonical SMILES for 2-chloro-10H-phenoxazine is Clc1ccc2c(c1)Nc1ccccc1O2.
What is the InChIKey of 2-chloro-10H-phenoxazine?
The InChIKey is ZLPPJJZCOCPXDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClNO/c13-8-5-6-12-10(7-8)14-9-3-1-2-4-11(9)15-12/h1-7,14H.
What are the key properties of 2-chloro-10H-phenoxazine?
2-chloro-10H-phenoxazine has a molecular weight of 217.66 g/mol, XLogP of 4.19, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-10H-phenoxazine is sourced from PubChem (CID 10632580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).