Basic information
- CAS
84434-83-3- Standard SMILES
CCN(CC)CCNCc1ccc(Cl)cc1- InChIKey
QMHPWYDPGOPWPA-UHFFFAOYSA-N- Molecular formula
- C13H21ClN2
- Average molar mass
- 240.77 g/mol
- Monoisotopic mass
- 240.13932635
Names & identifiers
- Preferred name
- N-[(4-chlorophenyl)methyl]-N',N'-diethylethane-1,2-diamine
- IUPAC
- N-[(4-chlorophenyl)methyl]-N',N'-diethylethane-1,2-diamine
- English name
- N-[(4-chlorophenyl)methyl]-N',N'-diethylethane-1,2-diamine
- Molecular formula
- C13H21ClN2
- Molecular weight
- 240.77
Names & synonyms
84434-83-3[(4-chlorophenyl)methyl][2-(diethylamino)ethyl]amineN-[(4-chlorophenyl)methyl]-N',N'-diethylethane-1,2-diamineN1-(4-chlorobenzyl)-N2,N2-diethylethane-1,2-diamineNSC165828SCHEMBL1724753DTXSID60304455QMHPWYDPGOPWPA-UHFFFAOYSA-NJDA43483AKOS000236784NSC-165828SB81216
Show more names
N2-[(4-Chlorophenyl)methyl]-N1,N1-diethyl-1,2-ethanediamine1,2-Ethanediamine, N2-[(4-chlorophenyl)methyl]-N1,N1-diethyl-
CS-0242731EN300-254381G53874N'-(4-CHLOROBENZYL)-N,N-DIETHYLETHYLENEDIAMINEN-[(4-chlorophenyl)methyl]-N',N'-diethyl-ethane-1,2-diamineN~2~-[(4-Chlorophenyl)methyl]-N~1~,N~1~-diethylethane-1,2-diamine
Database identifiers
- CAS
84434-83-3- PubChem CID
- 296048
- DTXSID
DTXSID60304455- EC Number
- 105-382-3
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Boiling point
- 126 · 126-128 °C(Press: 0.7 Torr)
- Density
- 1.034 · 1.034±0.06 g/cm3(Predicted)
- pka
- 10.11 · 10.11±0.25(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
6 records
Compound notes
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