Home Carboxys (4-Methoxyphenyl)methyl 1H-pyrrole-2-carboxylate

(4-Methoxyphenyl)methyl 1H-pyrrole-2-carboxylate

CAS No.:
1881320-48-4
Catalog Number:
AG00I2BQ
Molecular Formula:
C13H13NO3
Molecular Weight:
231.2472
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$188
- +
5g
96%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG00I2BQ
Chemical Name:
(4-Methoxyphenyl)methyl 1H-pyrrole-2-carboxylate
CAS Number:
1881320-48-4
Molecular Formula:
C13H13NO3
Molecular Weight:
231.2472
MDL Number:
MFCD29043334
IUPAC Name:
(4-methoxyphenyl)methyl 1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C13H13NO3/c1-16-11-6-4-10(5-7-11)9-17-13(15)12-3-2-8-14-12/h2-8,14H,9H2,1H3
InChI Key:
IRDUNCZWOOQNDO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)COC(=O)c1ccc[nH]1
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.09g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.251g/mol
Monoisotopic Mass:
231.09g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties