Benzyltributylammonium chloride

CAT: 0926-FB34280-01Size: 5 KgDry Ice: NoHazardous: No

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CAT#:0926-FB34280-01Size:5 Kg

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CAS Number

23616-79-7

MDL Number

MFCD00011849

Smiles

CCCC[N+] (CCCC) (CCCC) CC1=CC=CC=C1.[Cl-]

Molecular Formula

C19H34ClN

Molecular Weight

311.93 g/mol

Controlled

Chemical Information

Benzyltributylammonium chloride

CAS Number	23616-79-7
PubChem CID	159952
IUPAC Name	benzyl(tributyl)azanium chloride
Molecular Formula	C19H34ClN
Molecular Weight	311.9
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	11
Heavy Atom Count	21
Formal Charge	0
Complexity	196

SMILES

CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C19H34N.ClH/c1-4-7-15-20(16-8-5-2,17-9-6-3)18-19-13-11-10-12-14-19;/h10-14H,4-9,15-18H2,1-3H3;1H/q+1;/p-1

InChIKey

VJGNLOIQCWLBJR-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 23616-79-7

CID: 159952

Formula: C19H34ClN

MW: 311.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	311.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	11
Exact Mass	311.2379778
Monoisotopic Mass	311.2379778
Topological Polar Surface Area	0 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	196
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
FD65524-01	Diosmetinidin chloride
FD61260-01	Dimethylthiocarbamoyl chloride
FD33717-01	Decanoyl chloride
FC71316-01	Cinnamoyl chloride
FC52987-01	Cyclopropanesulfonyl chloride
FC161212-01	Cyclobutanesulfonyl chloride
FBA04485-01	Chelirubine chloride
FB74002-01	Berberrubine chloride
FB138878-01	Benzal Chloride
KAA01968	Desmosine chloride

Catalog	Name
HY-ER019-01	Benzyltributylammonium (chloride)
TRC-B316178-2.5G	Benzyltributylammonium Chloride
TRC-B316188-250MG	Benzyltributylammonium Bromide
189775-01	Phenyl Methanesulphonyl Chloride (α-Toluenesulphonyl Chloride; Phenylmethylsulphonyl Chloride)
HY-W012954S-01	TMA chloride-d12 (chloride)
3125490	Tin chloride (stannous chloride)
3121645	Cobalt chloride (Cobaltous chloride)
3121825	Cupric chloride (Copper chloride)
sc-279274	Lithium chloride-potassium chloride
TRC-B188800-5G	Phenylacetyl Chloride(Benzeneacetyl Chloride)