CAS 625435-02-1 N-(2-fluorobenzyl)cyclopropanamine (HCID 1080490)

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Basic information

CAS: 625435-02-1
Standard SMILES: Fc1ccccc1CNC1CC1
InChIKey: UZYPFBRRGVZJNV-UHFFFAOYSA-N
Molecular formula: C10H12FN
Average molar mass: 165.21 g/mol
Monoisotopic mass: 165.09537755

Names & identifiers

Preferred name: N-(2-fluorobenzyl)cyclopropanamine
IUPAC: N-[(2-fluorophenyl)methyl]cyclopropanamine
English name: Benzenemethanamine, N-cyclopropyl-2-fluoro- (9CI)
Molecular formula: C10H12FN
Molecular weight: 165.21

Names & synonyms

N-(2-fluorobenzyl)cyclopropanamineRefChem:825386858-479-4625435-02-1N-[(2-fluorophenyl)methyl]cyclopropanamineCyclopropyl-(2-fluoro-benzyl)-amineMFCD04035532Benzenemethanamine, N-cyclopropyl-2-fluoro- (9CI)N-Cyclopropyl-2-fluorobenzylaminecyclopropyl[(2-fluorophenyl)methyl]amineBENZENEMETHANAMINE, N-CYCLOPROPYL-2-FLUORO-SCHEMBL696339

Show more names

N-Cyclopropyl-2-fluorobenzylaMine, 97%N-cyclopropyl-2-fluoro-Benzenemethanamine

Cyclopropyl(2-fluorobenzyl)amineDTXSID10360122Cyclopropyl-(2-fluorobenzyl)amineUZYPFBRRGVZJNV-UHFFFAOYSA-NHMS1704O11SBB085355AKOS000200520TS-02221

Database identifiers

CAS: 625435-02-1
PubChem CID: 1080490
DTXSID: DTXSID10360122
EC Number: 858-479-4

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 12 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 12
Formal charge: 0
Complexity: 145

Physicochemical properties

Boiling point: 231.3 · 231.3±15.0 °C(Predicted)
Density: 1.09 · 1.09±0.1 g/cm3(Predicted)
pka: 7.78 · 7.78±0.20(Predicted)
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314-H318
Precautionary statements: 260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501
HS Code: 2921490090 · 2921490090

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (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 CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

Safety data

hs_code: 2921490090
Signal word: Danger
Symbol(GHS): GHS05
Hazard statements: H314-H318
Precautionary statements: P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501