Home Aldehydes 3-(2,2-dimethylpropoxy)benzaldehyde

3-(2,2-dimethylpropoxy)benzaldehyde

CAS No.:
1260801-38-4
Catalog Number:
AG01EM80
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
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Product Description
Catalog Number:
AG01EM80
Chemical Name:
3-(2,2-dimethylpropoxy)benzaldehyde
CAS Number:
1260801-38-4
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
MDL Number:
MFCD11847079
IUPAC Name:
3-(2,2-dimethylpropoxy)benzaldehyde
InChI:
InChI=1S/C12H16O2/c1-12(2,3)9-14-11-6-4-5-10(7-11)8-13/h4-8H,9H2,1-3H3
InChI Key:
HQYLNKMRHHMXQQ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCC(C)(C)C
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties