Home Aldehydes 38982-12-6
38982-12-6,MFCD09751223
Catalog No.:AA003I34
38982-12-6 | 3-(9-Anthryl)acrylaldehyde
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5g
>98.0%(GC)
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Technical Information
Catalog Number:
AA003I34
Chemical Name:
3-(9-Anthryl)acrylaldehyde
CAS Number:
38982-12-6
Molecular Formula:
C17H12O
Molecular Weight:
232.2766
MDL Number:
MFCD09751223
IUPAC Name:
(E)-3-anthracen-9-ylprop-2-enal
InChI:
InChI=1S/C17H12O/c18-11-5-10-17-15-8-3-1-6-13(15)12-14-7-2-4-9-16(14)17/h1-12H/b10-5+
InChI Key:
NLHDGEXLFCDTHQ-BJMVGYQFSA-N
SMILES:
O=C/C=C/c1c2ccccc2cc2c1cccc2
EC Number:
254-235-0
Properties
Computed Properties
 
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
232.089g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.282g/mol
Monoisotopic Mass:
232.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

Synonyms
 
38982-12-6 
3-(9-Anthryl)acrolein 
3-(9-anthryl) acrylaldehyde 
SCHEMBL1308315 
Jsp006789 
(E)-3-(9-Anthryl)acrylaldehyde 
MFCD09751223 
ZINC22116439 
(E)-3-(9-anthracenyl)-2-propenal 
(E)-3-(anthracen-9-yl)acrylaldehyde 
AKOS015840928 
AKOS025311054 
3-(9-Anthryl)acrylaldehyde 
ACM38982126 
3-(9-Anthryl)-2-propenal, AldrichCPR 
AK173149 
N960 
TR-015667 
A824361 
I14-0872 
3- acrylaldehyde 
C17H12O 
C17-H12-O 
3-(Anthracen-9-yl)acrylaldehyde 
CID6365417 
(4-Hydroxyphenyl)-2-butanone beta-d-glucoside 
4-[4-(beta-d-glucopyranosyloxy)phenyl]-2-butanone 
(E)-3-anthracen-9-ylprop-2-enal 
EINECS 254-235-0 
3-(9-anthryl) acrolein 
Anthracene-9-propenal 
EC 254-235-0 
AC1O4DF1 
Literature
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