Home Other Building Blocks 2-methyl-3-(4-propylphenyl)propanal

2-methyl-3-(4-propylphenyl)propanal

CAS No.:
902274-65-1
Catalog Number:
AG01BTGO
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
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Product Description
Catalog Number:
AG01BTGO
Chemical Name:
2-methyl-3-(4-propylphenyl)propanal
CAS Number:
902274-65-1
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
MDL Number:
MFCD20385028
IUPAC Name:
2-methyl-3-(4-propylphenyl)propanal
InChI:
InChI=1S/C13H18O/c1-3-4-12-5-7-13(8-6-12)9-11(2)10-14/h5-8,10-11H,3-4,9H2,1-2H3
InChI Key:
MYFZHVIROUHFHS-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)CC(C=O)C
NSC Number:
22272
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.136g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.286g/mol
Monoisotopic Mass:
190.136g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties