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Home> Encyclopedia > Hot Product Listed 7   > 7H-Pyrrolo[2,3-d]pyriMidine-6-carboxaMide, 2-chloro-7-cyclopentyl-N,N-diMethyl-
1211443-61-6 structure

7H-Pyrrolo[2,3-d]pyriMidine-6-carboxaMide, 2-chloro-7-cyclopentyl-N,N-diMethyl-

Iupac Name:2-chloro-7-cyclopentyl-N,N-dimethylpyrrolo[2,3-d]pyrimidine-6-carboxamide
CAS No.:1211443-61-6
EINECS(EC#): 808-234-2
Molecular Weight:292.767
Molecular Formula:C14H17ClN4O (isomer)
Names and Identifiers
Synonyms

2-chloro-7-cyclopentyl-7h-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid dimethyl amide 2-chloro-7-cyclopentyl-7h-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid dimethylamide 2-chloro-7-cyclopentyl-N,N-diMethyl-7H-pyrrolo[2,3-d]pyriMidine-6-arboxaMide 2-chloro-7-cyclopentyl-n,n-dimethyl-7h-pyrrolo[2,3-d]pyrimidine-6-carboxamide 7H-Pyrrolo[2,3-d]pyrimidine-6-carboxamide 7H-Pyrrolo[2,3-d]pyriMidine-6-carboxaMide, 2-chloro-7-cyclopentyl-N,N-diMethyl- AK198902 AKOS026674082 EOS-60967 PMDDQOHZLBZUSO-UHFFFAOYSA-N RIBOCICLIB INT Ribociclib-1 SCHEMBL1990321

Inchi
InChI=1S/C14H17ClN4O/c1-18(2)13(20)11-7-9-8-16-14(15)17-12(9)19(11)10-5-3-4-6-10/h7-8,10H,3-6H2,1-2H3
InChkey
PMDDQOHZLBZUSO-UHFFFAOYSA-N
Canonical Smiles
CN(C)C(=O)C1=CC2=CN=C(N=C2N1C3CCCC3)Cl
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin sensitization, Category 1B

Hazardous to the aquatic environment, short-term (Acute) - Category Acute 3

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)

H317 May cause an allergic skin reaction

H402 Harmful to aquatic life

H412 Harmful to aquatic life with long lasting effects

Precautionary statement(s)
Prevention

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

P272 Contaminated work clothing should not be allowed out of the workplace.

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

P273 Avoid release to the environment.

Response

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

P333+P313 If skin irritation or rash occurs: Get medical advice/attention.

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

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

Storage

none

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:292.767g/mol
  • Molecular Formula:C14H17ClN4O
  • Compound Is Canonicalized:True
  • Exact Mass:292.109
  • Monoisotopic Mass:292.109
  • Complexity:372
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:51A^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: AAADceBzoAAEAAAAAAAAAAAAAAAAAeIAAAAsAAAAAAAAAFgB+AAAHgIAAAAADCjBnwQ/sN8MEACo Azd3dACCgCk3AqAB2CG4ZNiIaPLA3fGUBQhoggLIyaYYAQAMAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
 
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