Basic information
- CAS
7617-75-6- Standard SMILES
CCCCCCCCCCCCCCCCCCOCCCN- InChIKey
GWOUPOJUVSKJCH-UHFFFAOYSA-N- Molecular formula
- C21H45NO
- Average molar mass
- 327.6 g/mol
- Monoisotopic mass
- 327.35011506
Names & identifiers
- Preferred name
- 1-Propanamine, 3-(octadecyloxy)-
- IUPAC
- 3-octadecoxypropan-1-amine
- English name
- 3-(octadecyloxy)propylamine
- Molecular formula
- C21H45NO
- Molecular weight
- 327.59
Names & synonyms
1-Propanamine, 3-(octadecyloxy)-7617-75-6EINECS 231-529-7DTXSID5064750RefChem:435885DTXCID30478493-(Octadecyloxy)propylamineoctadecyloxypropylamine3-(OCTADECYLOXY)PROPAN-1-AMINE3-octadecyloxypropylamineSCHEMBL116905SCHEMBL10706194
Show more names
Octadecyl 3-aminopropyl ether3-(Octadecyloxy)-1-propanamine
NS00037761
Database identifiers
- CAS
7617-75-6- PubChem CID
- 82087
- DTXSID
DTXSID5064750- EC Number
- 231-529-7
- Nikkaji
- J116.199G
Properties
Computed structural properties
- XLogP
- 8.3
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 20
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- EPA Substance Registry System
- 1 · 1-Propanamine, 3-(octadecyloxy)- (7617-75-6)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Propanamine, 3-(octadecyloxy)-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers2 total
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
8 records
Compound notes
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