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Home> Encyclopedia > Hot Product Listed 2   > 2,4(1H,3H)-Pyrimidinedione,5-fluoro-1-[(2R)-tetrahydro-2-furanyl]-
67633-63-0 structure

2,4(1H,3H)-Pyrimidinedione,5-fluoro-1-[(2R)-tetrahydro-2-furanyl]-

Iupac Name:ethyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium;ethyl sulfate
CAS No.:67633-63-0
Molecular Weight:522.82482
Molecular Formula:C9H16O2 (isomer)
Names and Identifiers
Synonyms

(R)-Ftorafur (r)-tegafur 076f689 1-((2r)oxolan-2-yl)-5-fluoro-1,3-dihydropyrimidine-2,4-dione 2,3h)-pyrimidinedione, 5-fluoro-1-(tetrahydro-2-furanyl)-, (r)- 2,4(1H,3H)-pyrimidinedione, 5-fluoro-1-(tetrahydro-2-furanyl)- 2,4(1H,3H)-Pyrimidinedione,5-fluoro-1-(tetrahydro-2-furanyl)-, (R)- 2124AH 5317337v7v 5-fluoro-1-(r)-tetrahydro-furan-2-yl-1h-pyrimidine-2,4-dione 5-fluoro-1-(tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione 5-fluoro-1-[(2r)-2-oxolanyl]pyrimidine-2,4-dione 5-fluoro-1-[(2r)-oxolan-2-yl]pyrimidine-2,4-dione 5-fluoro-1-[(r)-tetrahydrofuran-2-yl]uracil A812417 A823522 AB01566812_01 AC1L692Y acm37076689 AKOS024306980 Carzonal CCG-35341 CCG-36092 CHEMBL235993 F0635 FT-0653732 ftorafur, 17902-23-7 HE319380 MOLPORT-002-507-106 N1-(2'-Furanidyl)-5-fluorouracil NCIMECH_000223 NSC 200695 nsc148958 nsc-200695 S1300 SCHEMBL4553 ST50308301 Tegafur UNII-1548R74NSZ COMPONENT WFWLQNSHRPWKFK-ZCFIWIBFSA-N unii-5317337v7v

Inchi
InChI=1S/C25H52N2O.C2H6O4S/c1-6-27(4,5)23-19-22-26-25(28)21-18-16-14-12-10-8-7-9-11-13-15-17-20-24(2)3;1-2-6-7(3,4)5/h24H,6-23H2,1-5H3;2H2,1H3,(H,3,4,5)
InChkey
IMWSVOVXSVRHAO-UHFFFAOYSA-N
Canonical Smiles
CC[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCC(C)C.CCOS(=O)(=O)[O-]
Properties
Density
0.901
Boiling Point
567.8°C at 760 mmHg
Flash Point
262.3°C
Storage temp
2-8°C
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Skin irritation, Category 2

Serious eye damage, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H302 Harmful if swallowed

H315 Causes skin irritation

H318 Causes serious eye damage

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.

Response

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

P330 Rinse mouth.

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

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

P332+P313 If skin irritation occurs: Get medical advice/attention.

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

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P310 Immediately call a POISON CENTER/doctor/…

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:522.82482g/mol
  • Molecular Formula:C9H16O2
  • Compound Is Canonicalized:True
  • Exact Mass:522.407
  • Monoisotopic Mass:522.407
  • Complexity:456
  • Rotatable Bond Count:21
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Heavy Atom Count:35
  • 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:2
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