Basic information
- CAS
21103-33-3- Standard SMILES
COc1ccccc1N1CCN(CCCCN)CC1- InChIKey
UFJPFLDFMPVGRW-UHFFFAOYSA-N- Molecular formula
- C15H25N3O
- Average molar mass
- 263.38 g/mol
- Monoisotopic mass
- 263.19976242
Names & identifiers
- Preferred name
- 1-(4-Aminobutyl)-4-(2-methoxyphenyl)piperazine
- IUPAC
- 4-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-amine
- English name
- 4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butylamine
- Molecular formula
- C15H25N3O
- Molecular weight
- 263.38
Names & synonyms
1-(4-Aminobutyl)-4-(2-methoxyphenyl)piperazineRefChem:424753664-269-121103-33-34-(4-(2-Methoxyphenyl)piperazin-1-yl)butan-1-amine4-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-amine4-[4-(2-METHOXY-PHENYL)-PIPERAZIN-1-YL]-BUTYLAMINE4-(4-(2-methoxy-phenyl)-piperazin-1-yl)-butylamineSCHEMBL946736SCHEMBL30080718SCHEMBL30080722DTXSID80451399
Show more names
1-Piperazinebutanamine, 4-(2-methoxyphenyl)-4-[4-(2-Methoxyphenyl)-1-piperazinyl]butylamine1-(4-aMino-1-butyl)-4-(2-Methoxyphenyl)piperazine
UFJPFLDFMPVGRW-UHFFFAOYSA-NAKOS0001912504-(2-methoxyphenyl)-1-piperazinbutanamineDB-0144194-[4-(2-methyloxyphenyl)piperazinyl]butylamine1-(2-methoxyphenyl)-4-(4-aminobutyl)piperazine1-n(4-aminobutyl)-4-n(2-methoxyphenyl)piperazine4-(4-(2-methoxyphenyl)-1-piperazinyl)butylamine
Database identifiers
- CAS
21103-33-3- PubChem CID
- 10999903
- DTXSID
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 41.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 242
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
- Hazard Codes
- C
- Risk Statements
- 34 · 34-52
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 2735 PSN1 · UN 2735PSN1 8 / PGII
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Safety data
- ridadr
- UN 2735PSN1 8 / PGII
- risk_code
- 34-52
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- Hazard statements
- H314
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Suppliers1 total
天津凯利奇生物科技有限公司15076683720 · [email protected]
Related reactions
10 records
Compound notes
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