CAS 22795-99-9|CAS 22795-97-7|[(2R)-1-ethylpyrrolidin-2-yl]methanamine|[(2R)-1-ethylpyrrolidin-2-yl]methanamine|(S)-(-)-2-Aminomethyl-1-ethylpyrrolidine|(R)-(+)-2-Aminomethyl-1-ethylpyrrolidine|(R)-...

Molecular Formula

C₇H₁₆N₂

Molecular Mass

128.21534

Exact Mass

128.13134852

InChI

InChI=1S/C7H16N2/c1-2-9-5-3-4-7(9)6-8/h7H,2-6,8H2,1H3/t7-/m1/s1

InChIKey

UNRBEYYLYRXYCG-SSDOTTSWSA-N

Canonic Smiles

NC[C@H]1CCCN1CC

Isomeric Smiles

N1([C@H](CCC1)CN)CC

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-4.905204

LogD (pH = 7.4)

-2.7165408

Log P

0.21555814

Molar Refractivity

39.8977

Polarizability

15.965017

Polar Surface Area

29.26

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

854138

IUPAC name

[(2R)-1-ethylpyrrolidin-2-yl]methanamine

Synonyms

(S)-(-)-2-Aminomethyl-1-ethylpyrrolidine(R)-(+)-2-Aminomethyl-1-ethylpyrrolidine(R)-(+)-2-氨甲基-1-乙基吡咯烷

IUPAC Traditional name

[(2R)-1-ethylpyrrolidin-2-yl]methanamine

PubChem SID

162076364

Physical Property

Product Information

Empirical Formula (Hill Notation)

C7H16N2

Purity

90%

95%

GHS Pictograms

Corrosive to metals, category 1

Skin corrosion, categories 1A,1B,1C

Serious eye damage, category 1

Acute toxicity (oral, dermal, inhalation), category 4

Skin irritation, category 2

Eye irritation, category 2

Skin sensitisation, category 1

Specific Target Organ Toxicity – Single exposure, category 3

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

Acute toxicity (oral, dermal, inhalation), categories 1,2,3

P261-P280-P305+P351+P338

P210-P301+P310-P303+P361+P353-P305+P351+P338-P405-P501A

Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US)

26-39

23-26-36/37/39-60

H226-H302-H315-H318-H335

H301-H315-H335-H318-H226

UN 1993 3/PG 3

1993

UN1993

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Sigma Aldrich

681709

Packaging
1 g in glass bottle

No Data Available

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Academic Data

PubChem

854138

IUPAC name

[(2R)-1-ethylpyrrolidin-2-yl]methanamine

Synonyms

(S)-(-)-2-Aminomethyl-1-ethylpyrrolidine(R)-(+)-2-Aminomethyl-1-ethylpyrrolidine(R)-(+)-2-氨甲基-1-乙基吡咯烷

IUPAC Traditional name

[(2R)-1-ethylpyrrolidin-2-yl]methanamine

PubChem SID

162076364

Sigma Aldrich

681709

Packaging
1 g in glass bottle

No Data Available

Click here to submit data

Physical Property

Product Information

Empirical Formula (Hill Notation)

C7H16N2

Purity

90%

95%

Safety Information

Molecule

ID:89484