Home Other Building Blocks 3,4-diethylbenzoic acid

3,4-diethylbenzoic acid

CAS No.:
186253-12-3
Catalog Number:
AG01A4KY
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01A4KY
Chemical Name:
3,4-diethylbenzoic acid
CAS Number:
186253-12-3
MDL Number:
MFCD20644292
IUPAC Name:
3,4-diethylbenzoic acid
InChI:
InChI=1S/C11H14O2/c1-3-8-5-6-10(11(12)13)7-9(8)4-2/h5-7H,3-4H2,1-2H3,(H,12,13)
InChI Key:
FIUWNZQAIGJKSK-UHFFFAOYSA-N
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.099g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.231g/mol
Monoisotopic Mass:
178.099g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties