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3,5-?????-2-????????

3,5-?????-2-????????
3,5-?????-2-???????? ??? ???
?? ??:
2199-58-8
???:
3,5-?????-2-????????
???(??):
3,5-?????-2-????????
???:
3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde
???(??):
3,5-DIMETHYL-1H-PYRROLE-2-CARBALDEHYDE;1H-Pyr;PYR-9588;2-ForMyl-3,5-diMethylpyrrole;3,5-Dimethyl-2-formyl-1H-pyrrole;2,4-DiMethylpyrrole-5-carboxaldehyde;3,5-Dimethyl-2-pyrrolecarboxaldehyde;3,5-DIMETHYLPYRROLE-2-CARBOXALDEHYDE;3,5-Dimethyl-1H-pyrrol-2-carbaldehyde;3,5-Dimethyl-2-pyrrolecarboxaldehyde>
CBNumber:
CB8468167
???:
C7H9NO
??? ??:
123.15
MOL ??:
2199-58-8.mol
MSDS ??:
SDS

3,5-?????-2-???????? ??

???
95-99 °C (lit.)
?? ?
237.3±35.0 °C(Predicted)
??
1.099±0.06 g/cm3(Predicted)
?? ??
Keep in dark place,Sealed in dry,Room Temperature
???
DMSO????? ???
?? ?? (pKa)
16.23±0.50(Predicted)
??? ??
??
??? ??
??? ??
??
?? ??
??
Air Sensitive
InChI
InChI=1S/C7H9NO/c1-5-3-6(2)8-7(5)4-9/h3-4,8H,1-2H3
InChIKey
RDFZYUOHJBXMJA-UHFFFAOYSA-N
SMILES
N1C(C)=CC(C)=C1C=O
CAS ??????
2199-58-8(CAS DataBase Reference)
??
  • ?? ? ?? ??
  • ?? ? ???? ?? (GHS)
??? ?? Xi
?? ???? ?? 36/37/38
????? 26-36/37
WGK ?? 3
HS ?? 29339900
???? ??? 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
????(GHS): Exclamation Mark (GHS07)
?? ?: Warning
??·?? ??:
?? ??·?? ?? ?? ?? ?? ?? ? ?? ?? P- ??
H315 ??? ??? ??? ????? ?? ????? ?? 2 ?? P264, P280, P302+P352, P321,P332+P313, P362
H319 ?? ?? ??? ??? ?? ? ?? ?? ??? ?? ?? 2A ?? P264, P280, P305+P351+P338,P337+P313P
H335 ?? ???? ??? ? ?? ?? ???? ?? - 1? ??;???? ?? ?? 3 ??
??????:
P261 ??·?·??·???·??·...·????? ??? ????.
P264 ?? ??? ?? ??? ????.
P264 ?? ??? ?? ??? ????.
P271 ?? ?? ??? ? ?? ???? ?????.
P280 ????/???/???/?????? ?????.
P302+P352 ??? ??? ??? ?? ????.
P305+P351+P338 ?? ??? ? ?? ?? ???? ????. ???? ?????? ?????. ?? ????.
NFPA 704
1
2 0

3,5-?????-2-???????? C??? ??, ??, ??

??? ??

Colorless solid

??

3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde is an intermediate used in the synthesis of a series of anaplastic lymphoma kinase (ALK) inhibitors, a new target for therapy of non-small-cell lung cancer (NSCLC).

3,5-?????-2-???????? ?? ?? ? ???

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3,5-?????-2-???????? ?? ??

???( 194)?? ??
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