2-(3,5-Dichlorophenyl)pyrrolidine
Basic information
- CAS
887344-13-0- Standard SMILES
Clc1cc(Cl)cc(C2CCCN2)c1- InChIKey
RGJUGOHYPAYSDI-UHFFFAOYSA-N- Molecular formula
- C10H11Cl2N
- Average molar mass
- 216.1 g/mol
- Monoisotopic mass
- 215.0268547
Names & identifiers
- Preferred name
- 2-(3,5-Dichlorophenyl)pyrrolidine
- IUPAC
- 2-(3,5-dichlorophenyl)pyrrolidine
- English name
- 2-(3,5-Dichlorophenyl)Pyrrolidine
- Molecular formula
- C10H11Cl2N
- Molecular weight
- 216.11
Names & synonyms
2-(3,5-dichlorophenyl)pyrrolidine887344-13-02-(3,5-DICHLOROPHENYL]PYRROLIDINEDTXSID303949242-[3,5-DICHLOROPHENYL]PYRROLIDINERefChem:251276DTXCID20345783815-727-6MFCD02684093SCHEMBL1712816RGJUGOHYPAYSDI-UHFFFAOYSA-NAR1037
Show more names
Pyrrolidine, 2-(3,5-dichlorophenyl)-2-(3,5-Dichlorophenyl)tetrahydropyrrole, 1,3-Dichloro-5-(pyrrolidin-2-yl)benzene
AKOS000148335AKOS016343605FD53091AS-45012SY239184DB-078145CS-0070579EN300-1707696
Database identifiers
- CAS
887344-13-0- PubChem CID
- 3677656
- DTXSID
DTXSID30394924- EC Number
- 815-727-6
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 164
Physicochemical properties
- Density
- 1.25 · 1.250
- form
- Liquid
- InChI
- InChI=1S/C10H11Cl2N/c11-8-4-7(5-9(12)6-8)10-2-1-3-13-10/h4-6,10,13H,1-3H2
- InChIKey
- RGJUGOHYPAYSDI-UHFFFAOYSA-N
- SMILES
- N1CCCC1C1=CC(Cl)=CC(Cl)=C1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2933998090 · 2933998090
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
H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (66.7%)
Safety data
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesUsed as an intermediate for organic synthesis.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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