Basic information
- Standard SMILES
NCC1CC1- InChIKey
IGSKHXTUVXSOMB-UHFFFAOYSA-N- Molecular formula
- C4H9N
- Average molar mass
- 71.12 g/mol
- Monoisotopic mass
- 71.07349929
Names & identifiers
- Preferred name
- Cyclopropanemethanamine
- IUPAC
- cyclopropylmethanamine
- English name
- Aminomethylcyclopropane
- Molecular formula
- C4H9N
- Molecular weight
- 71.12
Names & synonyms
2516-47-4CyclopropanemethylamineCyclopropanemethanamineEINECS 219-737-6DTXSID4062482RefChem:581177DTXCID6037229219-737-6CyclopropylmethanamineCyclopropylmethylamine(Aminomethyl)cyclopropane1-cyclopropylmethanamine
Show more names
AURORA KA-7613RARECHEM AL BW 0002CyclopropylmethanaminCyclopropanmethylaminC-Cyclopropylmethylamine
AminomethylcyclopropaneCyclopropane methyl amineMFCD00037147(cyclopropylmethyl)amine9L6cyclopropylmethylamincyclopropanmethylaminecyclopropyhnethylamine
Database identifiers
- CAS
2516-47-4- PubChem CID
- 75646
- DTXSID
DTXSID4062482- EC Number
- 219-737-6
- Nikkaji
- J80.509B
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 30.6
Experimental & physicochemical properties
SpringerMaterials PropertiesCoriolis coupling
Physicochemical properties
- Boiling point
- 86 °C758 · 86 °C758 mm Hg(lit.)
- Density
- 0.83 g/mL · 0.83 g/mL at 20 °C(lit.)
- refractive index
- 20 · n20/D 1.434(lit.)
- Flash point
- 23 °F · −23 °F
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- Liquid
- pka
- 10.41 · 10.41±0.29(Predicted)
- Specific Gravity
- 0.82 · 0.82
- color
- Clear colorless to pale yellow
- Water Solubility
- Fully miscible in water.
- BRN
- 773674 · 773674
- InChI
- 1S/C4H9N.H2O/c5-3-4-1-2-4;/h4H,1-3,5H2;1H2
- InChIKey
- IGSKHXTUVXSOMB-UHFFFAOYSA-N
- SMILES
- O.NCC1CC1
- CAS DataBase Reference
- 2516 · 2516-47-4(CAS DataBase Reference)
- NIST Chemistry Reference
- (Aminomethyl)cyclopropane(2516-47-4)
- EPA Substance Registry System
- Cyclopropanemethanamine (2516-47-4)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05
- Signal word
- Danger
- Hazard statements
- 225 · H225-H314
- Precautionary statements
- 210 · P210-P280-P305+P351+P338-P310
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- F,C
- Risk Statements
- 11 · 11-34
- Safety Statements
- 16 · 16-26-36/37/39-45-24/25
- RIDADR
- 2733 · UN 2733 3/PG 2
- WGK Germany
- 3 · 3
- F
- 34 · 34
- Hazard Note
- Highly Flammable/Corrosive
- TSCA
- TSCA listed
- HazardClass
- 3 · 3
- PackingGroup
- II
- HS Code
- 29213099 · 29213099
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 2 Skin · Flam. Liq. 2Skin Corr. 1B
Safety & regulation
GHS classification
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 49 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 CategoriesFlam. Liq. 2 (100%)
Safety data
- F
- 34
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2733 3/PG 2
- hs_code
- 29213099
- risk_code
- 11-34
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05
- hazard_code
- F,C
- hazard_note
- Highly Flammable/Corrosive
- safety_code
- 16-26-36/37/39-45-24/25
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- Hazard statements
- H225-H314
- Hazard Classifications
- Flam. Liq. 2Skin Corr. 1B
- Precautionary statements
- P210-P280-P305+P351+P338-P310
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCyclopropanemethanamine: ACTIVE
Applications
UsesAminomethylcyclopropane is a cyclic compound with structural analogy to glycine used in studies of potential inhibitors of glycine cleavage system of brain and liver mitochondria.
UsesCyclopropanemethylamine used in studies of potential inhibitors of glycine cleavage system of brain and liver mitochondria. It is used in chemical synthesis.
General DescriptionInfrared (3500-50cm-1) spectra of gaseous and Raman (3500-50cm-1) spectra of liquid aminomethyl cyclopropane (cyclopropyl methylamine) has been reported. It was extracted by solid-phase micro extraction (SPME) from black rice grain.
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