Butylamine

Các tên gọi khác (3) :

1-aminobutane
1-butanamine
n-butylamine

Thuốc Gốc

Small Molecule

CAS: 109-73-9

CTHH: C₄H₁₁N

PTK: 73.1368

Butylamine is an organic compound, specifically, an amine. This colourless liquid is one of the four isomeric amines of butane, the others being sec-butylamine, tert-butylamine and isobutylamine. At standard temperature and pressure, n-butylamine is a liquid having the fishy, ammonia-like odor common to amines. The liquid acquires a yellow colour upon storage in air. It is soluble in all organic solvents. [Wikipedia]

Nhận Dạng Quốc Tế & Đặc Tính Hóa Học

Công thức hóa học

C₄H₁₁N

Phân tử khối

73.1368

Monoisotopic mass

73.089149357

InChI

InChI=1S/C4H11N/c1-2-3-4-5/h2-5H2,1H3

InChI Key

InChIKey=HQABUPZFAYXKJW-UHFFFAOYSA-N

IUPAC Name

butan-1-amine

Traditional IUPAC Name

butylamine

SMILES

CCCCN

Độ tan chảy

-49.1 °C

Độ sôi

77 °C

Độ hòa tan

1E+006 mg/L (at 20 °C)

logP

0.97

logS

0.04

pKa (Strongest Basic)

10.21

PSA

26.02 Å²

Refractivity

23.79 m³·mol^-1

Polarizability

9.66 Å³

Rotatable Bond Count

H Bond Acceptor Count

H Bond Donor Count

Physiological Charge

Number of Rings

Bioavailability

Rule of Five

true

pKa

10.8 (at 20 °C)

Độc Tính : Oral rat LD₅₀ is 366 mg/kg.

Tài Liệu Tham Khảo Thêm

drugbank

http://www.drugbank.ca/drugs/DB03659

PubChem Compound

http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=8007

PubChem Substance

http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46508030

Wikipedia

http://en.wikipedia.org/wiki/N-Butylamine

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