Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed C   > CHEMBRDG-BB 6530210
84-74-2 structure

CHEMBRDG-BB 6530210

Iupac Name:dibutyl benzene-1,2-dicarboxylate
CAS No.:84-74-2
Molecular Weight:278.348
Molecular Formula:C12H7N3O4S (isomer)
Names and Identifiers
Synonyms

4-bromo-2-(((1-propyl-1h-benzo[d]imidazol-2-yl)amino)methyl)phenol 4-BROMO-2-([(1-PROPYL-1H-BENZIMIDAZOL-2-YL)AMINO]METHYL)PHENOL 4-bromo-2-[[(1-propylbenzimidazol-2-yl)amino]methyl]phenol 4-bromo-2-{[(1-propyl-1h-benzimidazol-2-yl)amino]methyl}phenol AC1LQ0P2 acm384351728 AJ-25081 AK-99721 AKOS001651681 CTK4H9944 DTXSID80361848 EU-0009040 HE340080 MCULE-2827783187 mfcd02943223 MOLPORT-002-206-633 STK031104 STOCK2S-80585 VU0060937-1 W-9870 ZINC1176519 zx-cm016756

Inchi
InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3
InChkey
DOIRQSBPFJWKBE-UHFFFAOYSA-N
Canonical Smiles
CCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC
Properties
Density
1.16
Melting Point
-35℃
Boiling Point
334.5°C at 760 mmHg
Refractive Index
1.491
HS Code
29173100
Safety and Handling
Risk Statements
R61;R50;R62
Safety Statements
S53;S45;S61
HazardClass
9
Hazard Note
H360Df; H400
PackingGroup
III
Transport
UN 2810/9095/3082
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 1000_10000 view >
INTERMEDIATE INDIVIDUAL INTERMEDIATE_USE_ONLY view >
INTERMEDIATE JOINT INTERMEDIATE_USE_ONLY view >
INTERMEDIATE INDIVIDUAL INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
DEZA a.s. 2013
ExponentOR28 2012
HUNTSMAN HOLLAND BV 2016
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Hazardous to the aquatic environment, short-term (Acute) - Category Acute 1

Reproductive toxicity, Category 1B

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H400 Very toxic to aquatic life

H360Df

Precautionary statement(s)
Prevention

P273 Avoid release to the environment.

P201 Obtain special instructions before use.

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

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

Response

P391 Collect spillage.

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:278.348g/mol
  • Molecular Formula:C12H7N3O4S
  • Compound Is Canonicalized:True
  • XLogP3-AA:4.7
  • Exact Mass:278.152
  • Monoisotopic Mass:278.152
  • Complexity:271
  • Rotatable Bond Count:10
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:52.6A^2
  • Heavy Atom Count:20
  • 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: AAADceB4OAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGgAAAAAADACgmAIyCIAABACI AiDSCAACAAAkAAAIiAEACMgIJjKANRiCMQAkwAEIqYfLyKCOgAAAAAAQAAAAAAAAACAAAAAAAAAA AA==
Recommended Suppliers
  • Tel:0086-27-59207850
  • Fax:0086-27-59524646
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-21-61124658
  • Fax:86-21-61294103
  • Tel:86-573-85350588
  • Fax:86-573-85350688
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
  • Tel:86-27-87465837
  • Fax:86-27-87772287
  • Tel:86-21-60542966
  • Fax:86-21-61916468
  • Tel:0086-0311-68050511
  • Fax:0086-0311-68050511
  • Tel:86-22-59853797
  • Fax:86-22-58823400
  • Tel:0086-532-87010898
  • Fax:0086-532-87010898
Recommended Suppliers
  • Tel:0086-27-59207850
  • Fax:0086-27-59524646
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-21-61124658
  • Fax:86-21-61294103
  • Tel:86-573-85350588
  • Fax:86-573-85350688
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
  • Tel:86-27-87465837
  • Fax:86-27-87772287
  • Tel:86-21-60542966
  • Fax:86-21-61916468
  • Tel:0086-0311-68050511
  • Fax:0086-0311-68050511
  • Tel:86-22-59853797
  • Fax:86-22-58823400
  • Tel:0086-532-87010898
  • Fax:0086-532-87010898
 
<