Home Aldehydes 24019-66-7
24019-66-7,MFCD00037364
Catalog No.:AA003IQT
24019-66-7 | 3-Allylsalicylaldehyde
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  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA003IQT
Chemical Name:
3-Allylsalicylaldehyde
CAS Number:
24019-66-7
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
MDL Number:
MFCD00037364
IUPAC Name:
2-hydroxy-3-prop-2-enylbenzaldehyde
InChI:
InChI=1S/C10H10O2/c1-2-4-8-5-3-6-9(7-11)10(8)12/h2-3,5-7,12H,1,4H2
InChI Key:
INLWEXRRMUMHKB-UHFFFAOYSA-N
SMILES:
C=CCc1cccc(c1O)C=O
Properties
Computed Properties
 
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.068g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
162.188g/mol
Monoisotopic Mass:
162.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Synonyms
 
3-Allyl-2-hydroxybenzaldehyde 
24019-66-7 
ACMC-209wev 
AC1L3IA2 
TPC-SK001 
2-Hydroxy-3-allylbenzaldehyde 
3-Allylsalicylaldehyde, 97% 
SCHEMBL617923 
TPC-B001 
CTK4F2767 
3-Allyl-2-hydroxybenzaldehyde # 
DTXSID80178751 
3-Allylsalicylaldehyde 
OR7500T 
ACT00896 
ALBB-018715 
BCP15030 
ZINC1420514 
ZX-AN034438 
ZX-AT000589 
ANW-46277 
CA-634 
FCH931939 
3-Allyl-2-hydroxy-benzaldehyde 
SBB010096 
AKOS000300715 
2-oxidanyl-3-prop-2-enyl-benzaldehyde 
MCULE-5036151620 
PS-5911 
TRA0083766 
ACM24019667 
AJ-25757 
AK-86392 
BAS 02801117 
Benzaldehyde, 2-hydroxy-3-(2-propenyl)- 
CC-13964 
SC-88769 
AB0023655 
AX8011823 
DB-010051 
TR-043745 
FT-0614893 
R1659 
ST24028375 
ST50213391 
Salicylaldehyde, 3-allyl- 
W4757 
X4650 
Benzaldehyde,2-hydroxy-3-(2-propen-1-yl)- 
A17300 
F10149 
019A667 
A817043 
C-04208 
I01-8751 
C10H10O2 
2-hydroxy-3-prop-2-enylbenzaldehyde 
CID141062 
ZINC01420514 
3-Allylsalicylaldehyde, 96.5% - 1G 1g 
Benzaldehyde, 2-hydroxy-3-(2-propen-1-yl)- 
INLWEXRRMUMHKB-UHFFFAOYSA-N 
MFCD00037364 
2-hydroxy-3-(prop-2-en-1-yl)benzaldehyde 
Literature

Title: Small-molecule activation of procaspase-3 to caspase-3 as a personalized anticancer strategy.

Journal: Nature chemical biology 20061001

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