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Home> Hot Product Listed P   > Propanamide,3-[[4-(cyclohexylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]amino]-N-phenyl-
87-66-1 structure

Propanamide,3-[[4-(cyclohexylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]amino]-N-phenyl-

CAS No.:87-66-1
EINECS(EC#): 248-203-5
Molecular Weight:126.11004
Molecular Formula:C10H15CLN2S (isomer)
Names and Identifiers
Synonyms

3-[[[4-(Cyclohexylamino)-9,10-dihydro-9,10-dioxoanthracen]-1-yl]amino]-N-phenylpropanamide 3-[[4-(cyclohexylamino)-9,10-dihydro-9,10-dioxoanthryl]amino]-n-phenylpropionamide AC1L3K5L AC1Q5NC5 einecs 246-275-2 PL034893

Inchi
InChI=1/C6H6O3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H
InChkey
WQGWDDDVZFFDIG-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=C(C(=C1)O)O)O
Properties
Density
1.33
Melting Point
131-135℃
Vapour
10 mm Hg ( 167.7 °C)
Refractive Index
n20/D 1.387
Flash Point
126°C
Safety and Handling
Risk Statements
R20/21/22;R52/53;R68
Safety Statements
S36/37;S61
HazardClass
6.1
Hazard Note
H302; H312; H332; H341; H412
PackingGroup
III
Transport
UN 1814/2811
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  
INTERMEDIATE JOINT INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Acute toxicity - Dermal, Category 4

Acute toxicity - Inhalation, Category 4

Germ cell mutagenicity, Category 2

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H302 Harmful if swallowed

H312 Harmful in contact with skin

H332 Harmful if inhaled

H341 Suspected of causing genetic defects

H412 Harmful to aquatic life with long lasting effects

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.

P261 Avoid breathing dust/fume/gas/mist/vapours/spray.

P271 Use only outdoors or in a well-ventilated area.

P201 Obtain special instructions before use.

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

P273 Avoid release to the environment.

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.

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

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:126.11004g/mol
  • Molecular Formula:C10H15CLN2S
  • XLogP3-AA:0.5
  • Exact Mass:126.031694
  • Monoisotopic Mass:126.031694
  • Complexity:84.3
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:60.7
  • Heavy Atom Count:9
  • 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
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  • Tel:86-571-88938639
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  • Fax:0086-27-59524646
  • Tel:86-571-87758665
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