Basic information
- CAS
15468-86-7- Standard SMILES
C=CCNc1nc(Cl)nc(NCC=C)n1- InChIKey
JVNONOVWALQTEB-UHFFFAOYSA-N- Molecular formula
- C9H12ClN5
- Average molar mass
- 225.68 g/mol
- Monoisotopic mass
- 225.07812306
Names & identifiers
- Preferred name
- N,N'-Diallyl-6-chloro-1,3,5-triazine-2,4-diamine
- IUPAC
- 6-chloro-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
- English name
- N,N'-diallyl-6-chloro-1,3,5-triazine-2,4-diamine
- Molecular formula
- C9H12ClN5
- Molecular weight
- 225.67808
Names & synonyms
N,N'-Diallyl-6-chloro-1,3,5-triazine-2,4-diamineC7BN4VYW9JEINECS 239-488-7UNII-C7BN4VYW9JDTXSID601657001,3,5-TRIAZINE-2,4-DIAMINE, 6-CHLORO-N2,N4-DI-2-PROPEN-1-YL-6-CHLORO-N2,N4-DI-2-PROPEN-1-YL-1,3,5-TRIAZINE-2,4-DIAMINERefChem:160983DTXCID8088191239-488-715468-86-76-chloro-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
Show more names
Aids019766Aids-0197662,4-Bis(allylamino)-6-chloro-S-triazine2,4-Diallylamino-6-chloro-1,3,5-triazine6-Chloro-N,N'-diallyl-1,3,5-triazine-2,4-diamine
N2,N4-diallyl-6-chloro-1,3,5-triazine-2,4-diamineN,N/'-Diallyl-6-chloro-1,3,5-triazine-2,4-diamineSCHEMBL4856408GEO-04218MFCD03035621AKOS005594753NS000250232,4-bis-allylamino-6-chloro-1,3,5-triazine
Database identifiers
- CAS
15468-86-7- PubChem CID
- 27306
- DTXSID
DTXSID60165700- UNII
- C7BN4VYW9J
- EC Number
- 239-488-7
- Nikkaji
- J317.927C
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 191
Experimental & physicochemical properties
LogP2.75
Physicochemical properties
- FDA UNII
- 7 BN4VYW9J · C7BN4VYW9J
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
济南睿思医药技术有限公司0531-0531-69900633 19963472814 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
3 records
Compound notes
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