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Basic information
- CAS
4253-76-3- Standard SMILES
CCCCCCCCCCCCCCCCCCNCCCN- InChIKey
DXYUWQFEDOQSQY-UHFFFAOYSA-N- Molecular formula
- C21H46N2
- Average molar mass
- 326.6 g/mol
- Monoisotopic mass
- 326.36609947
Overview
solution used in process of heparnizing cathetercoat surface with groups of positively charged ions; RN given refers to parent cpd
Names & identifiers
- Preferred name
- N1-Octadecyl-1,3-propanediamine
- IUPAC
- N'-octadecylpropane-1,3-diamine
- English name
- N-octadecylpropane-1,3-diamine
- Molecular formula
- C21H46N2
- Molecular weight
- 326.6
Names & synonyms
4253-76-3Octadecyliminipropylamine39HN1J1N5TDTXSID20195321N1-Octadecyl-1,3-propanediamine1,3-Propanediamine, N-octadecyl-, dihydrochlorideRefChem:831088DTXCID30117812octadecyliminipropylamine-dihydrochlorideN-Octadecylpropane-1,3-diamineDuomeen oN'-octadecylpropane-1,3-diamine
Show more names
Ai3-28243N-Stearyl 1,3-propanediamine
1,3-Propanediamine, N-octadecyl-N-STEARYLTRIMETHYLENEDIAMINEN1-Octadecylpropane-1,3-diaminen-octadecyltrimethylenediamineUNII-39HN1J1N5Tn-octadecyl-1,3-propanediamineEINECS 224-224-5stearylaminopropylamine
Database identifiers
- CAS
4253-76-3- PubChem CID
- 77931
- DTXSID
DTXSID20195321- UNII
- 39HN1J1N5T
- EC Number
- 224-224-5
- Nikkaji
- J205.666F
Properties
Computed structural propertiesFilling in
- XLogP
- 8
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 20
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 194
Experimental & physicochemical properties
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physicochemical properties
- Boiling point
- 208 · 208-214 °C(Press: 2 Torr)
- Density
- 0.842 · 0.842±0.06 g/cm3(Predicted)
- pka
- 10.67 · 10.67±0.19(Predicted)
- Indirect Additives used in Food Contact Substances
- N-STEARYLTRIMETHYLENEDIAMINE
- FDA 21 CFR
- 175.3 · 175.300
- FDA UNII
- 39 HN1J1N5T · 39HN1J1N5T
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 1,3-Propanediamine, N-octadecyl-
Chemistry & industry
Suppliers23 total
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
信联瑞生物医药科技（山东）有限公司0531-84567878 15153173989 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
上海凝远贸易有限公司021-54415088 13003227123 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
湖北世腾化工科技有限公司18971850150 19086915685 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
英伟凯生物科技（上海）有限公司13012862996 · [email protected]
箴德化工科技（上海）有限公司15601952568 · [email protected]
南京新瑞医药科技有限公司19850079587 · [email protected]
上海仲骏化工有限公司15618409868 · [email protected]
Related reactions
2 records
Compound notes
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