162124
N-Butylmethylamine
96%
Synonym(s):
N-Methylbutylamine
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About This Item
Linear Formula:
CH3NH(CH2)3CH3
CAS Number:
Molecular Weight:
87.16
Beilstein:
1209231
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
Assay
96%
refractive index
n20/D 1.3995 (lit.)
bp
90.5-91.5 °C (lit.)
density
0.736 g/mL at 25 °C (lit.)
SMILES string
CCCCNC
InChI
1S/C5H13N/c1-3-4-5-6-2/h6H,3-5H2,1-2H3
InChI key
QCOGKXLOEWLIDC-UHFFFAOYSA-N
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Application
N-Butylmethylamine was used in synthesis of N-n-butyl-N-methyl-N-2-(1-phenyl)propyl-amine and 16α-(bromoalkylamide) derivatives of estradiol.
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 4 Oral - Flam. Liq. 2 - Skin Corr. 1B
Storage Class Code
3 - Flammable liquids
WGK
WGK 3
Flash Point(F)
30.2 °F - closed cup
Flash Point(C)
-1 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Tetrahedron, 56(29), 5157-5162 (2000)
J D Pelletier et al.
Bioorganic & medicinal chemistry, 4(10), 1617-1628 (1996-10-01)
To develop inhibitors of 17 beta-hydroxysteroid dehydrogenase (17 beta-HSD) without residual estrogenic activity, the synthesis of 16 alpha-(bromoalkylamide) derivatives of estradiol was performed starting from a key intermediate aldehyde obtained from commercially available estrone. In addition, series of 16 alpha-(bromoalkyl)
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