6-chloro-2-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine

HCID 18304

Basic information

CAS
3071-66-7
Standard SMILES
CCCNc1nc(Cl)nc(NCCC)n1
InChIKey
WKFQDZJPQYALOP-UHFFFAOYSA-N
Molecular formula
C9H16ClN5
Average molar mass
229.71 g/mol
Monoisotopic mass
229.10942319

Names & identifiers

Preferred name
6-chloro-2-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine
IUPAC
6-chloro-2-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine
English name
1,3,5-Triazine-2,4-diamine, 6-chloro-N2,N4-dipropyl-
Molecular formula
C9H16ClN5
Molecular weight
229.71

Names & synonyms

6-chloro-2-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine3071-66-7DTXSID40274607RefChem:307864DTXCID502260766-CHLORO-N2,N4-DIPROPYL-1,3,5-TRIAZINE-2,4-DIAMINETimTec1_000851SCHEMBL2490426WKFQDZJPQYALOP-UHFFFAOYSA-NHMS1536G15AKOS017547958NCGC00175055-01
Show more names
1,3,5-Triazine-2,4-diamine, 6-chloro-N2,N4-dipropyl-
ST009526BRD-K70010949-001-01-16-chloro-N,N'-dipropyl-[1,3,5]triazine-2,4-diamine6-Chloro-N,N'-di-n-propyl-[1,3,5]triazine-2,4-diamine[6-chloro-4-(propylamino)(1,3,5-triazin-2-yl)]propylamine6-Chloro-N~2~,N~4~-dipropyl-1,3,5-triazine-2,4-diamine

Database identifiers

CAS
3071-66-7
PubChem CID
18304
DTXSID
DTXSID40274607
Nikkaji
J1.553.376E

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
62.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
15

Physicochemical properties

Melting point
210.5 · 210.5-212.0 °C
Boiling point
387 · 387.0±25.0 °C(Predicted)
Density
1.235 · 1.235±0.06 g/cm3(Predicted)
pka
2.56 · 2.56±0.10(Predicted)

Chemistry & industry

Suppliers7 total

成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
Wuhan Jingkang en Biomedical Technology Co., Ltd+86-0086-13720134139 · [email protected]
上海技毅生物科技有限公司13621943973 · [email protected]
武汉沃格达生物科技有限公司15071299552 · [email protected]

Related reactions

30 records

Compound notes

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