6-(3,3,3-Tribromopropyl)-1,3,5-triazine-2,4-diamine

HCID 73010

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Basic information

CAS: 62160-38-7
Standard SMILES: Nc1nc(N)nc(CCC(Br)(Br)Br)n1
InChIKey: NFTZMPBDLXUMMM-UHFFFAOYSA-N
Molecular formula: C6H8Br3N5
Average molar mass: 389.87 g/mol
Monoisotopic mass: 386.83298

Names & identifiers

Preferred name: 6-(3,3,3-Tribromopropyl)-1,3,5-triazine-2,4-diamine
IUPAC: 6-(3,3,3-tribromopropyl)-1,3,5-triazine-2,4-diamine

Names & synonyms

6-(3,3,3-tribromopropyl)-1,3,5-triazine-2,4-diamine62160-38-7s-Triazine, 2,4-diamino-6-(3,3,3-tribromopropyl)-NSC 299165BRN 05216662,4-Diamino-6-(3,3,3-tribromopropyl)-s-triazineNSC2991652,4-Diamino-6-(3,3,3-tribromopropyl)-1,3,5-triazine1,3,5-Triazine-2,4-diamine, 6-(3,3,3-tribromopropyl)-SCHEMBL11143022DTXSID80211218NSC-299165

Show more names

1,5-Triazine-2,4-diamine, 6-(3,3,3-tribromopropyl)-

Database identifiers

CAS: 62160-38-7
PubChem CID: 73010
DTXSID: DTXSID80211218
Nikkaji: J92.254D

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 90.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 175

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