Home Aldehydes 69770-23-6
69770-23-6,MFCD00003359
Catalog No.:AA003I2O
69770-23-6 | 3-(4-tert-Butylphenoxy)benzaldehyde
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1g
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5g
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10g
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Technical Information
Catalog Number:
AA003I2O
Chemical Name:
3-(4-tert-Butylphenoxy)benzaldehyde
CAS Number:
69770-23-6
Molecular Formula:
C17H18O2
Molecular Weight:
254.3236
MDL Number:
MFCD00003359
IUPAC Name:
3-(4-tert-butylphenoxy)benzaldehyde
InChI:
InChI=1S/C17H18O2/c1-17(2,3)14-7-9-15(10-8-14)19-16-6-4-5-13(11-16)12-18/h4-12H,1-3H3
InChI Key:
YZIHNHLGGMSWAD-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)Oc1ccc(cc1)C(C)(C)C
EC Number:
274-109-9
UNII:
IW9QVO2DJU
Properties
Computed Properties
 
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.131g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.329g/mol
Monoisotopic Mass:
254.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  

Synonyms
 
3-(4-tert-Butylphenoxy)benzaldehyde 
69770-23-6 
AC1L3SN9 
AC1Q1M8Y 
ACMC-1B3N8 
SCHEMBL417164 
DTXSID5022300 
CTK5D1312 
ZINC56518 
3(4-t-butyl-phenoxy)benzaldehyde 
m-(p-tert-Butyphenoxy)benzaldehyde 
MFCD00003359 
UNII-IW9QVO2DJU 
AKOS009158716 
3-(4-tert-butyl-phenoxy)-benzaldehyde 
3-(4-tert-Butylphenoxy)benzaldehyde, 98% 
DB-021680 
LS-184982 
TC-170180 
FT-0641255 
3-[4-(1,1-Dimethylethyl)phenoxy]benzaldehyde 
A836640 
Benzaldehyde, 3-[4-(1,1-dimethylethyl)phenoxy]- 
IW9QVO2DJU 
I01-18292 
3- BENZALDEHYDE 
C17H18O2 
CID94653 
AR-1E7133 
ZINC00056518 
3-[4-(tert-butyl)phenoxy]benzaldehyde 
C17-H18-O2 
71954-46-6 
EINECS 274-109-9 
3-(4-(tert-Butyl)phenoxy)benzaldehyde 
YZIHNHLGGMSWAD-UHFFFAOYSA-N 
Benzaldehyde,3-[4-(1,1-dimethylethyl)phenoxy]- 
3-{[4-(1,1-dimethylethyl)phenyl]oxy}benzaldehyde 
AC1Q6QDM 
Literature
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