Benzyltributylammonium Bromide

CAT: 0572-TRC-B316188-250MGSize: 250 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-B316188-250MGSize:250 mg

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CAS Number

25316-59-0

Hazard Statement

No Data Available

Smiles

[Br-].CCCC[N+](CCCC)(CCCC)Cc1ccccc1

Molecular Formula

C19H34BrN

Molecular Weight

356.39

Shipping Conditions

Room Temperature

Chemical Information

Benzyltributylammonium bromide

CAS Number	25316-59-0
PubChem CID	124611
IUPAC Name	benzyl(tributyl)azanium
Molecular Formula	C19H34N+
Molecular Weight	276.5
XLogP	5.5
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	11
Heavy Atom Count	20
Formal Charge	1
Complexity	196

SMILES

CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1

InChI

InChI=1S/C19H34N/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/q+1

InChIKey

QSRFYFHZPSGRQX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 25316-59-0

CID: 124611

Formula: C19H34N+

MW: 276.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	276.5
XLogP3	5.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	11
Exact Mass	276.269125089
Monoisotopic Mass	276.269125089
Topological Polar Surface Area	0 Å²
Heavy Atom Count	20
Formal Charge	1
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	1
Compound Is Canonicalized	Yes

Catalog	Name
TRC-B316178-2.5G	Benzyltributylammonium Chloride
TRC-B316178-250MG	Benzyltributylammonium Chloride
TRC-B316178-500MG	Benzyltributylammonium Chloride
TRC-M223750-5G	Mepenzolate Bromide
TRC-S465055-100MG	Silver Bromide
TRC-D212453-10G	Decamethonium Bromide
TRC-P465000-10MG	Pinaverium Bromide
TRC-O293250-500MG	Octylonium Bromide
TRC-C588670-25MG	Clopidogrel Bromide
TRC-M174985-5G	Mercury Bromide

Catalog	Name
sc-227349	Benzyltributylammonium bromide
HY-ER019-01	Benzyltributylammonium (chloride)
FB34280-01	Benzyltributylammonium chloride
29309654-500g	Hexadecyltrimethylammonium bromide (Cetyltrimethylammonium bromide)
CB0105	Cetyldimethylethyl ammonium bromide (Ethylhexadecyldimethylammonium bromide)
AR-I03852-01	Ipratropium Bromide Impurity 11 Bromide
AR-R11297-01	Rocuronium Bromide Impurity 7 Bromide
AR-U01225-01	Umeclidinium Bromide Impurity 6 Bromide
O5553-02	Octylonium Bromide (Spasmonen. Otilonium Bromide)
AR-I03850-01	Ipratropium Bromide Impurity 6 Bromide