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Home Aldehydes Benzaldehyde diethyl acetal

Benzaldehyde diethyl acetal

CAS No.:
774-48-1
Catalog Number:
AG003O0F
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$32
- +
5g
95%
In Stock USA
United States
$75
- +
25g
95%
In Stock USA
United States
$213
- +
Product Description
Catalog Number:
AG003O0F
Chemical Name:
Benzaldehyde diethyl acetal
CAS Number:
774-48-1
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
MDL Number:
MFCD00038525
IUPAC Name:
diethoxymethylbenzene
InChI:
InChI=1S/C11H16O2/c1-3-12-11(13-4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3
InChI Key:
MAQMEXSLUSZDQM-UHFFFAOYSA-N
SMILES:
CCOC(c1ccccc1)OCC
EC Number:
212-265-1
UNII:
236M0R125W
NSC Number:
287
Properties
Complexity:
113  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.115g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.247g/mol
Monoisotopic Mass:
180.115g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
2-Bromo-ethyl 2-chloro-6-methyl-quinoline-3-carboxyl-ate. Acta crystallographica. Section E, Structure reports online 20100401
Properties