(2-(Pyrrolidin-1-yl)phenyl)methanamine
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Basic information
- CAS
72752-53-5- Standard SMILES
NCc1ccccc1N1CCCC1- InChIKey
PLXNYYYHSZRVJH-UHFFFAOYSA-N- Molecular formula
- C11H16N2
- Average molar mass
- 176.26 g/mol
- Monoisotopic mass
- 176.13134852
Overview
(2-Pyrrolidin-1-ylphenyl)methylamine is a member of pyrrolidines.
Names & identifiers
- Preferred name
- (2-(Pyrrolidin-1-yl)phenyl)methanamine
- IUPAC
- (2-pyrrolidin-1-ylphenyl)methanamine
- English name
- (2-PYRROLIDIN-1-YLPHENYL)METHYLAMINE
- Molecular formula
- C11H16N2
- Molecular weight
- 176.26
Names & synonyms
(2-(Pyrrolidin-1-yl)phenyl)methanamine[2-(pyrrolidin-1-yl)phenyl]methanamineRefChem:395184812-985-172752-53-52-(1-Pyrrolidinyl)benzylamine(2-Pyrrolidin-1-ylphenyl)methylamine(2-pyrrolidin-1-ylphenyl)methanamine2-Pyrrolidin-1-yl-benzylamineMFCD049710891-[2-(pyrrolidin-1-yl)phenyl]methanamine(2-pyrrolidinylphenyl)methylamine
Show more names
AKOS B022102ART-CHEM-BB B0221022-PYRROLIDINOBENZYLAMINE2-(1-Pyrrolidinyl)Benzenemethanamine1-(2-pyrrolidin-1-ylphenyl)methanamine(2-Pyrrolidin-1-ylphenyl)methylamine 97%
2-(Pyrrolidin-1-yl)benzylamineBenzenemethanamine, 2-(1-pyrrolidinyl)-SCHEMBL111729orb3031516SCHEMBL6159274SCHEMBL27585339DTXSID30426113CHEBI:195059
Database identifiers
- CAS
72752-53-5- PubChem CID
- 6924577
- DTXSID
DTXSID30426113- ChEBI
CHEBI:195059- EC Number
- 812-985-1
- Nikkaji
- J1.504.528K
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 152
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 280 · P280
- Hazard Codes
- C
- RIDADR
- 2735 · UN2735
- Hazard Note
- Corrosive
- HazardClass
- IRRITANT
- HS Code
- 2933998090 · 2933998090
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
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+H312 (25%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oral; acute toxicity, dermal]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (50%)
Safety data
- ridadr
- UN2735
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- C
- hazard_note
- Corrosive
- hazard_class
- IRRITANT
- Hazard statements
- H302-H312-H332
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Precautionary statements
- P280
Chemistry & industry
Additional notes
DefinitionChEBI: (2-Pyrrolidin-1-ylphenyl)methylamine is a member of pyrrolidines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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