5-chloro-N-{1-[4-(difluoromethoxy)phenyl]propyl}-6-methylpyrimidin-4-amine (Q19278300)

Diflumetorim (English)

9 October 2016

chemical formula

C₁₅H₁₆ClF₂N₃O

1 reference

Diflumetorim (English)

9 October 2016

canonical SMILES

CCC(C1=CC=C(C=C1)OC(F)F)NC2=NC=NC(=C2Cl)C

1 reference

Diflumetorim (English)

InChI=1S/C15H16ClF2N3O/c1-3-12(21-14-13(16)9(2)19-8-20-14)10-4-6-11(7-5-10)22-15(17)18/h4-8,12,15H,3H2,1-2H3,(H,19,20,21)

9 October 2016

Identifiers

InChI

1 reference

Diflumetorim (English)

9 October 2016

2 references

Diflumetorim (English)

9 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

130339-07-0

1 reference

https://commonchemistry.cas.org/detail?cas_rn=130339-07-0

9 April 2021

1 reference

diflumetorim (prov) (English)

9 October 2016

2 references

Diflumetorim (English)

9 October 2016

ChEBI ID

82861

mapping relation type

2 references

5-chloro-N-{1-[4-(difluoromethoxy)phenyl]propyl}-6-methylpyrimidin-4-amine (English)

9 October 2016

International Chemical Identifier

InChI

InChI=1S/C15H16ClF2N3O/c1-3-12(21-14-13(16)9(2)19-8-20-14)10-4-6-11(7-5-10)22-15(17)18/h4-8,12,15H,3H2,1-2H3,(H,19,20,21)

SureChEMBL ID

SCHEMBL23037

2 references

based on heuristic

inferred from InChIKey

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

1 reference

2 references

DSSTOX compound identifier

DTXCID9031723

0 references

EC number

603-407-7

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.121.866

27 December 2018

ECHA Substance Infocard ID

5-chloro-N-{1-[4-(difluoromethoxy)phenyl]propyl}-6-methylpyrimidin-4-amine (English)

quotation

CAS no.: 130339-07-0 (English)

100.121.866

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.121.866

27 December 2018

5-chloro-N-{1-[4-(difluoromethoxy)phenyl]propyl}-6-methylpyrimidin-4-amine (English)

quotation

CAS no.: 130339-07-0 (English)

UNII

HGZ4LD5DT9

1 reference