2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine

C10H6ClF2N3O2 — CID 2779596

IUPAC2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine
SMILESCOc1nc(Cl)nc(Oc2ccc(F)cc2F)n1
InChIInChI=1S/C10H6ClF2N3O2/c1-17-9-14-8(11)15-10(16-9)18-7-3-2-5(12)4-6(7)13/h2-4H,1H3
InChIKeyQQPBVLCDMHRNHH-UHFFFAOYSA-N
MW273.63 g/mol
LogP2.60
Rot. Bonds3

About 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine

2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine (PubChem CID 2779596) has the molecular formula C10H6ClF2N3O2 and a molecular weight of 273.63 g/mol. Its IUPAC name is 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine.

Molecular Properties

Compound Name2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine
PubChem CID2779596
Molecular FormulaC10H6ClF2N3O2
Molecular Weight273.63 g/mol
Exact Mass273.01
IUPAC Name2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine
SMILESCOc1nc(Cl)nc(Oc2ccc(F)cc2F)n1
InChIInChI=1S/C10H6ClF2N3O2/c1-17-9-14-8(11)15-10(16-9)18-7-3-2-5(12)4-6(7)13/h2-4H,1H3
InChIKeyQQPBVLCDMHRNHH-UHFFFAOYSA-N
XLogP2.60
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.63
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

CID 15973
CID 15973
CID 25271557
CID 25271557
CID 10573660
CID 10573660
CID 15111
CID 15111
CID 14724248
CID 14724248
CID 2782796
CID 2782796
CID 62859977
CID 62859977
CID 15569239
CID 15569239
CID 20807
CID 20807
CID 793499
CID 793499
CID 35010
CID 35010
CID 2782795
CID 2782795

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine?
The IUPAC name of 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine (CID 2779596) is 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine.
What is the SMILES notation for 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine?
The canonical SMILES for 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine is COc1nc(Cl)nc(Oc2ccc(F)cc2F)n1.
What is the InChIKey of 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine?
The InChIKey is QQPBVLCDMHRNHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClF2N3O2/c1-17-9-14-8(11)15-10(16-9)18-7-3-2-5(12)4-6(7)13/h2-4H,1H3.
What are the key properties of 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine?
2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine has a molecular weight of 273.63 g/mol, XLogP of 2.60, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(2,4-difluorophenoxy)-6-methoxy-1,3,5-triazine is sourced from PubChem (CID 2779596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).