1-Butanaminium,N,N,N-tripropyl-, bromide (1:1) supplier

Name
butyltripropylammonium bromide
EINECS 262-637-2
CAS No. 61175-77-7
Article Data3
CAS DataBase
Density
Solubility
Melting Point
Formula C₁₃H₃₀BrN
Boiling Point
Molecular Weight 280.292
Flash Point
Transport Information
Appearance
Safety 26-37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Butanaminium,N,N,N-tripropyl-, bromide (9CI);Butyltripropylammonium bromide;
PSA 0.00000
LogP 0.83730

1-Butanaminium,N,N,N-tripropyl-, bromide (1:1) Specification

The 1-Butanaminium,N,N,N-tripropyl-, bromide (1:1), with the CAS registry number 61175-77-7, is also known as N,N,N-Tripropylbutan-1-aminium bromide. Its EINECS registry number is 262-637-2. This chemical's molecular formula is C₁₃H₃₀BrN and molecular weight is 280.288. What's more, its IUPAC name is called Butyl(tripropyl)azanium bromide.

Physical properties about 1-Butanaminium,N,N,N-tripropyl-, bromide (1:1) are: (1)ACD/LogP: -2.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.41; (4)ACD/LogD (pH 7.4): -2.41; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.17; (8)ACD/KOC (pH 7.4): 1.17; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 0 Å².

You can still convert the following datas into molecular structure:
(1) SMILES: [Br-].C([N+](CCC)(CCC)CCCC)CC
(2) InChI: InChI=1/C13H30N.BrH/c1-5-9-13-14(10-6-2,11-7-3)12-8-4;/h5-13H2,1-4H3;1H/q+1;/p-1
(3) InChIKey: SXUONWAMSFNGTD-REWHXWOFAN

Product Name

butyltripropylammonium bromide

1-Butanaminium,N,N,N-tripropyl-, bromide (1:1) Specification

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