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Butylchlorotin dihydroxide

HCID 83368
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Basic information

CAS
13355-96-9
Standard SMILES
CCC[CH2][Sn][Cl].O.O
InChIKey
YWFUVTMPYOLBDB-UHFFFAOYSA-M
Molecular formula
C4H13ClO2Sn
Average molar mass
247.31 g/mol
Monoisotopic mass
247.96261

Names & identifiers

Preferred name
Butylchlorotin dihydroxide
IUPAC
butyl(chloro)tin;dihydrate
English name
Butylchlorodihydroxytin
Molecular formula
C4H11ClO2Sn
Molecular weight
245.29

Names & synonyms

13355-96-9Stannane, butylchlorodihydroxy-Butyltin chloride dihydroxideButylchlorotin dihydroxideButylchlorodihydroxystannaneButyl(chloro)stannanediolbutylchlorostannanediolFWL74QMO8FEINECS 236-406-1NSC 323990NSC-323990BUTYLTIN DIHYDROXYCHLORIDE
Show more names
SKL1142TIB KAT 250FASCAT 4101C4H11ClO2Sntib kat 250 supplierfascat 4101 supplierButylchlorodihdroxytin
DTXSID4044797RefChem:571826DTXCID2024797236-406-1ButylchlorodihydroxytinBUTYLTINCHLORIDEDIHYDROXIDEbutyl(chloro)tin;dihydrateMFCD00015822

Database identifiers

CAS
13355-96-9
PubChem CID
83368
DTXSID
DTXSID4044797
UNII
FWL74QMO8F
EC Number
236-406-1

Properties

Computed structural properties

Topological polar surface area
2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
8
Formal charge
0
Complexity
30

Physicochemical properties

Melting point
150 °C · 150 °C (dec.)(lit.)
Boiling point
243.2 · 243.2±23.0 °C(Predicted)
Density
1 · 1,26 g/cm3
vapor pressure
0.061 Pa · 0.061Pa at 20℃
storage temp.
30 °C · Store below +30°C.
solubility
1.03 mg/L · 1.03mg/L in organic solvents at 20 ℃
form
solid
pka
2.98 · 2.98±0.70(Predicted)
Specific Gravity
1.26 · 1.26
Water Solubility
1.03 mg/L · 1.03mg/L at 20℃
Hydrolytic Sensitivity
4 · 4: no reaction with water under neutral conditions
InChI
1S/C4H9.ClH.2H2O.Sn/c1-3-4-2;;;;/h1,3-4H2,2H3;1H;2*1H2;/q;;;;+3/p-3
InChIKey
FQYHHEJETOLDHR-UHFFFAOYSA-K
SMILES
CCCC[Sn](O)(O)Cl
LogP
0.35 at · 0.35 at 20℃
CAS DataBase Reference

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 0.5% (1 of 184) of reports.

Danger

H302 (21.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 184 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 3 items

Chemical: Stannane, butylchlorodihydroxy-

REACH registered substance: Butylchlorodihydroxystannane (EC: 236-406-1)

Stannane, butylchlorodihydroxy-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 4 (21.7%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
tsca
TSCA listed
hs_code
29319000
risk_code
20/21/22-36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn
safety_code
26-37/39
Storage Class

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationStannane, butylchlorodihydroxy-: ACTIVE
Applications · 2 items

DescriptionButylchlorodihydroxytin also known as Butyltin chloride dihydroxide, butyl(chloro)stannanediol, is one of several organotin compounds which are active as an esterification catalysts at a temperature range of 200-230 °C. It is a non-acidic white solid which has C4H11ClO2Sn as chemical formula. It dissolves by reaction on heating with alcohols or carboxylic acids. The resulting active is soluble in ester systems and remains in the ester product.

UsesButylchlorodihydroxytin is an amorphous, hydrolytically stable butyl tin chloride dihydroxide. It can be used for esterification, polycondensation and transesterification reactions. The catalyst is used to synthesize saturated polyester resin for powder coatings. Other uses include:production of unsaturated polyester resins for gel coat, sheet molding, and cast molding applicationsin transesterification reactions run at temperatures between 140-180°C to produce esters and anti-oxidantsin the production of PBT engineering resins for the automotive and construction markets

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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13355 · 13355-96-9(CAS DataBase Reference)
FDA UNII
74 QMO8F · FWL74QMO8F
EPA Substance Registry System
Stannane, butylchlorodihydroxy- (13355-96-9)
UNSPSC Code
12352103 · 12352103
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302+H312+H332-H315-H319-H335
Precautionary statements
261 · P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
target organs
Respiratory system
PPE
95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
Xn
Risk Statements
20 · 20/21/22-36/37/38
Safety Statements
26 · 26-37/39
WGK Germany
3 · 3
TSCA
TSCA listed
HS Code
29319000 · 29319000
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
4 DermalAcute · Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
REACH Registrations
Active
11 - Combustible Solids
target organs
Respiratory system
Hazard statements
H302+H312+H332-H315-H319-H335
REACH Registrations
Active
Hazard Classifications
Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements
P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338