p-((2-Chloroethyl)ethylamino)benzaldehyde
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Basic information
- CAS
2643-07-4- Standard SMILES
CCN(CCCl)c1ccc(C=O)cc1- InChIKey
MFUFJCIFNHFEDW-UHFFFAOYSA-N- Molecular formula
- C11H14ClNO
- Average molar mass
- 211.69 g/mol
- Monoisotopic mass
- 211.0763918
Names & identifiers
- Preferred name
- p-((2-Chloroethyl)ethylamino)benzaldehyde
- IUPAC
- 4-[2-chloroethyl(ethyl)amino]benzaldehyde
- English name
- 4-[(2-Chloroethyl)ethylamino]-benzaldehyde
- Molecular formula
- C11H14ClNO
- Molecular weight
- 211.69
Names & synonyms
2643-07-44-((2-Chloroethyl)(ethyl)amino)benzaldehydeBenzaldehyde, 4-[(2-chloroethyl)ethylamino]-4-[(2-chloroethyl)ethylamino]benzaldehyde4-[(2-Chloroethyl)(ethyl)amino]benzaldehydep-[(2-Chloroethyl)ethylamino]benzaldehydep-((2-Chloroethyl)ethylamino)benzaldehydeDTXSID20181022EINECS 220-150-2NSC 73020p-([2-Chloroethyl]ethylamino)benzaldehydeEC 220-150-2
Show more names
TIMTEC-BB SBB0076734-(N-Ethyl-N-chloroethyl)aminobenzaldehyde4-[(2-chloroethyl)ethylamino]-benzaldehydeN-ETHYL-N-CHLOROETHYL-4-AMINO BENZALDEHYDEP-[(2-CHLOROETHYL)ETHYLAMINO]-BENZALDEHYDEp-[N-(2-Chloroethyl)ethylamino]benzaldehydep-(N-(2-Chloroethyl)-N-ethyl)aminobenzaldehyde4-N-[2’Chloro ethyl]-N-ethyl amino-benzaldehyde
4-((2-Chloroethyl)ethylamino)benzaldehyde4-[[2-Chloroethyl)ethylamino]benzaldehyde4-[[2-Chloroethyl]ethylamino]benzaldehydeBenzaldehyde, 4-((2-chloroethyl)ethylamino)-RefChem:857901DTXCID30103513220-150-2InChI=1/C11H14ClNO/c1-2-13(8-7-12)11-5-3-10(9-14)4-6-11/h3-6,9H,2,7-8H2,1H
Database identifiers
- CAS
2643-07-4- PubChem CID
- 75842
- DTXSID
DTXSID20181022- UNII
- GW94D6D7XP
- EC Number
- 220-150-2
- Nikkaji
- J30.707F
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 167
Physicochemical properties
- Boiling point
- 162 °C · 162 °C(Press: 0.02 Torr)
- Density
- 1.153 · 1.153±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 2.19 · 2.19±0.50(Predicted)
- CAS DataBase Reference
- 2643 · 2643-07-4(CAS DataBase Reference)
- NIST Chemistry Reference
- P-([2-chloroethyl]ethylamino)benzaldehyde(2643-07-4)
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H314
- Precautionary statements
- 260 · P260-P264-P270-P280-P301+P310-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P330-P363-P405-P501
- REACH Registrations
- Inactive
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P270, P272, P273, P280, P301+P316, P302+P352, P317, P321, P330, P332+P317, P333+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 104 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Benzaldehyde, 4-[(2-chloroethyl)ethylamino]-
REACH registered substance: p-[(2-chloroethyl)ethylamino]benzaldehyde (EC: 220-150-2)
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- Hazard statements
- H301-H314
- REACH Registrations
- Inactive
- Precautionary statements
- P260-P264-P270-P280-P301+P310-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P330-P363-P405-P501
Related reactions
5 records
Compound notes
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