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Tri-n-butyl(1-propenyl)tin E and Z , CAS No.105494-65-3

COA

Cas Number: 105494-65-3
Molecular Weight: 331.12
PubChem CID: 5315049

In stock

Item Number

T165678

Grouped product items
SKU	Size	Availability	Price	Qty
T165678-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$247.90

Basic Description

Synonyms	CYCLOBENZAPRINEHCL \| ghl.PD_Mitscher_leg0.1273 \| Tri-N-butyl(1-propenyl)tin, AldrichCPR \| DTXSID801296844 \| Tri-n-butyl(1-propenyl)tin, cis + trans \| (Z)-Tributyl(prop-1-en-1-yl)stannane \| J-502669 \| J-525118 \| Tributyl(1E)-1-propen-1-ylstannane \| tributy
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organometallic compounds
  - Class Organo-post-transition metal compounds
    - Subclass Organotin compounds
      - Level5 Triorganotin compounds
        Level6 Trialkyltins

Kingdom	Organic compounds
Superclass	Organometallic compounds
Class	Organo-post-transition metal compounds
Subclass	Organotin compounds
Intermediate Tree Nodes	Triorganotin compounds
Direct Parent	Trialkyltins
Alternative Parents	Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Trialkyltin - Hydrocarbon derivative - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as trialkyltins. These are triorganotin compounds where the tin atom is linked to exactly three alkyl groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	tributyl-[(E)-prop-1-enyl]stannane
INCHI	InChI=1S/3C4H9.C3H5.Sn/c31-3-4-2;1-3-2;/h31,3-4H2,2H3;1,3H,2H3;
InChIKey	FJXYMVBFBYAWDR-UHFFFAOYSA-N
Smiles	CCCC[Sn](CCCC)(CCCC)C=CC
Isomeric SMILES	CCCC[Sn](CCCC)(CCCC)/C=C/C
Molecular Weight	331.12
Reaxy-Rn	3935279
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3935279&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	331.120 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	10
Exact Mass	332.153 Da
Monoisotopic Mass	332.153 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	150.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1

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