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Home> Hot Product Listed B   > BAS 00865630
1120-71-4 structure

BAS 00865630

Iupac Name:oxathiolane 2,2-dioxide
CAS No.:1120-71-4
Molecular Weight:122.138
Molecular Formula:C18H18BRNO4 (isomer)
Names and Identifiers
Synonyms

A1930/0081221 AKOS000526283 AKOS022016585 benzyl {[3-cyano-4-(2-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate benzyl 2-((3-cyano-4-(2-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)acetate benzyl 2-[[5-cyano-4-(2-methoxyphenyl)-2-oxo-3,4-dihydro-1h-pyridin-6-yl]sulfanyl]acetate benzyl 2-{[3-cyano-4-(2-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl]sulfanyl}acetate benzyl 2-{[3-cyano-4-(2-methoxyphenyl)-6-oxo-4,5-dihydro-1h-pyridin-2-yl]sulfanyl}acetate BG01696530 F0291-0009 MCULE-1633126696 MOLPORT-000-816-429 MOLPORT-001-902-606 OPREA1_158208 OPREA1_870415 sr-01000522646 SR-01000522646-1 STK725786 STOCK4S-89406

Inchi
InChI=1S/C3H6O3S/c4-7(5)3-1-2-6-7/h1-3H2
InChkey
FSSPGSAQUIYDCN-UHFFFAOYSA-N
Canonical Smiles
C1COS(=O)(=O)C1
Properties
Melting Point
30-33℃
Vapour
0.00237mmHg at 25°C
Refractive Index
1.4585 (20℃)
HS Code
29349990
Safety and Handling
Risk Statements
R45;R21/22
Safety Statements
S53;S45
HazardClass
6.1
PackingGroup
III
Transport
UN 2810
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
FULL JOINT 10_100 view >
INTERMEDIATE INDIVIDUAL INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
Raschig GmbH 2016
BASF Schwarzheide GmbH 2014
BASF SE 2014
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Acute toxicity - Dermal, Category 4

Carcinogenicity, Category 1B

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H302 Harmful if swallowed

H312 Harmful in contact with skin

H350 May cause cancer

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P270 Do not eat, drink or smoke when using this product.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

P201 Obtain special instructions before use.

P202 Do not handle until all safety precautions have been read and understood.

Response

P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/\u2026if you feel unwell.

P330 Rinse mouth.

P302+P352 IF ON SKIN: Wash with plenty of water/...

P312 Call a POISON CENTER/doctor/\u2026if you feel unwell.

P321 Specific treatment (see ... on this label).

P362+P364 Take off contaminated clothing and wash it before reuse.

P308+P313 IF exposed or concerned: Get medical advice/ attention.

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:122.138g/mol
  • Molecular Formula:C18H18BRNO4
  • Compound Is Canonicalized:True
  • Exact Mass:122.004
  • Monoisotopic Mass:122.004
  • Complexity:140
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:51.8A^2
  • Heavy Atom Count:7
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADcYBAMABAAAAAAAAAAAAAAAAAASAAAAAAAAAAAAAAAAAAAAAAGgQAAAAACACkwAKAAAAAAAIA AAAAAHBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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Recommended Suppliers
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  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-27-13407111142
  • Fax:86-27-13407111142
  • Tel:86-371-86658258
  • Fax:86-371-86658258
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-531-88110457
  • Fax:86-531-88113608
  • Tel:86-27-61188083
  • Fax:86-27-61188083
 
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