Home Other Building Blocks Methyl 4-formylbenzoate

Methyl 4-formylbenzoate

CAS No.:
1571-08-0
Catalog Number:
AG001P7S
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$57
- +
500g
98%
In Stock USA
United States
$207
- +
Product Description
Catalog Number:
AG001P7S
Chemical Name:
Methyl 4-formylbenzoate
CAS Number:
1571-08-0
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
MDL Number:
MFCD00006950
IUPAC Name:
methyl 4-formylbenzoate
InChI:
InChI=1S/C9H8O3/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-6H,1H3
InChI Key:
FEIOASZZURHTHB-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)C=O
EC Number:
216-385-5
UNII:
NH766742VV
NSC Number:
28459
Properties
Complexity:
169  
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  
Literature
Title Journal
Bis{μ-(E)-methyl 4-[(2-carbamothio-ylhydrazinyl-idene)meth-yl]benzoate-κS:S}bis-[iodido(triphenyl-phosphane-κP)copper(I)]. Acta crystallographica. Section E, Structure reports online 20111101
4-Carbomethoxybenzaldehyde as a highly sensitive pre-column fluorescence derivatization reagent for 9,10-phenanthrenequinone. Talanta 20110715
N-silyl oxyketene imines are underused yet highly versatile reagents for catalytic asymmetric synthesis. Nature chemistry 20101101
Methyl 4-(1H-benzimidazol-2-yl)benzoate trihydrate. Acta crystallographica. Section E, Structure reports online 20101101
Shoot differentiation from protocorm callus cultures of Vanilla planifolia (Orchidaceae): proteomic and metabolic responses at early stage. BMC plant biology 20100101
Potent and selective inhibitors of breast cancer resistance protein (ABCG2) derived from the p-glycoprotein (ABCB1) modulator tariquidar. Journal of medicinal chemistry 20090226
Organocatalysis by bimacrocyclic NHCs: unexpected formation of a cyclic hemiacetal instead of a gamma-butyrolactone. Organic & biomolecular chemistry 20090207
Synthesis and discovery of high affinity folate receptor-specific glycinamide ribonucleotide formyltransferase inhibitors with antitumor activity. Journal of medicinal chemistry 20080828
Factors affecting the selectivity of the oxidation of methyl p-toluate by cobalt(III). Inorganic chemistry 20080317
Synthesis and GIAO NMR calculations for some new 4,5-dihydro-1H-1,2,4-triazol-5-one derivatives: comparison of theoretical and experimental 1H and 13C chemical shifts. Magnetic resonance in chemistry : MRC 20050701
Solid-phase synthesis of 1-substituted tetrahydroisoquinoline derivatives employing BOC-protected tetrahydroisoquinoline carboxylic acids. Journal of combinatorial chemistry 20040101
The preparation of a series of nitrostilbene ester compounds using micro reactor technology. The Analyst 20010101
Properties