(S)-2-Methylbutylamin

2-Methylbutylamine, (S)-

HCID 2724272

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Grundinformationen

CAS: 34985-37-0
Standard-SMILES: CC[C@H](C)CN
InChIKey: VJROPLWGFCORRM-YFKPBYRVSA-N
Summenformel: C5H13N
Durchschnittliche Molmasse: 87,16 g/mol
Monoisotopische Masse: 87,10479942

Namen und Bezeichner

Bevorzugter Name: 2-Methylbutylamine, (S)-
IUPAC: (2S)-2-methylbutan-1-amine
Lokaler Name: (S)-2-Methylbutylamin
Englischer Name: (S)-(-)-2-Methylbutylamine
Summenformel: C5H13N
Molmasse: 87.16

Namen und Synonyme

34985-37-0(S)-(-)-2-Methylbutylamine(S)-2-Methylbutylamine1-Butanamine, 2-methyl-, (2S)-(S)-(-)-2-Methyl-1-butylamine(S)-2-Methylbutylamine, (-)-D8Q8RZF45X(S)-1-Amino-2-methylbutaneEINECS 252-307-6(2S)-2-METHYLBUTYLAMINEDTXSID3013118452-METHYLBUTYLAMINE, (S)-

Weitere Namen anzeigen

RARECHEM AL BW 2191(S)-2-Methylbutylamin[(2S)-2-Methylbutyl]amine(2S)-2-Methyl-1-butanamineS(-)-2-METHYL-1-BUTYLAMINE(2S)-2-Methylbutane-1-amine

(S)-2-METHYL-1-BUTANAMINE(S)-2-METHYL-1-BUTYLAMINES)-(-)-2-METHYLBUTYLAMINE1-BUTANAMINE, 2-METHYL-, (S)-RefChem:476008DTXCID501741664252-307-6(2S)-2-methylbutan-1-amine

Datenbank-Bezeichner

CAS: 34985-37-0
PubChem CID: 2724272
DTXSID: DTXSID301311845
ChEBI: CHEBI:231981
UNII: D8Q8RZF45X
EC Number: 252-307-6
Nikkaji: J63.092F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1
Polarare Oberfläche (TPSA): 26 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 6
Formalladung: 0
Komplexität: 27

Physikochemische Eigenschaften

Siedepunkt: 40 · 40-45 °C12 mm Hg(lit.)
Dichte: 0.756 g/mL · 0.756 g/mL at 20 °C(lit.)
Brechungsindex: 20 · n20/D 1.4126(lit.)
Flammpunkt: 38 °F · 38 °F
storage temp.: Flammables area
pka: 10.75 · 10.75±0.10(Predicted)
Aggregatzustand: liquid
Wasserlöslichkeit: Fully miscible in water.
BRN: 1718807 · 1718807
InChI: 1S/C5H13N/c1-3-5(2)4-6/h5H,3-4,6H2,1-2H3/t5-/m0/s1
InChIKey: VJROPLWGFCORRM-YFKPBYRVSA-N
SMILES: CC[C@H](C)CN

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H302 (91.1%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (91.1%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H332 (91.1%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesFlam. Liq. 2 (100%)；Acute Tox. 4 (91.1%)；Acute Tox. 4 (91.1%)；Skin Corr. 1B (100%)；Acute Tox. 4 (91.1%)

Sicherheitsdaten

F: 10-34
wgk: 3
ridadr: UN 2733 3/PG 2
risk_code: 11-20/21/22-34
hazard_code: F,C
safety_code: 16-26-36/37/39-45
hazard_class: 3
packing_group: II
Speicherklasse: 3 - Flammable liquids
Hazard Classifications: Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralFlam. Liq. 2Skin Corr. 1B