Home Other Building Blocks Methyl 3-formylbenzoate

Methyl 3-formylbenzoate

CAS No.:
52178-50-4
Catalog Number:
AG00375E
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$28
- +
5g
96%
In Stock USA
United States
$88
- +
10g
96%
In Stock USA
United States
$144
- +
25g
96%
In Stock USA
United States
$325
- +
100g
96%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG00375E
Chemical Name:
Methyl 3-formylbenzoate
CAS Number:
52178-50-4
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
MDL Number:
MFCD00189379
IUPAC Name:
methyl 3-formylbenzoate
InChI:
InChI=1S/C9H8O3/c1-12-9(11)8-4-2-3-7(5-8)6-10/h2-6H,1H3
InChI Key:
UVSBCUAQEZINCQ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)C=O
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.047g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.16g/mol
Monoisotopic Mass:
164.047g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties