Home Carboxes 113602-62-3
113602-62-3,MFCD12924083
Catalog No.:AA000912
113602-62-3 | Methyl 3-hydroxy-1-methyl-1h-pyrrole-2-carboxylate
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$85.00   $60.00
- +
250mg
95%
in stock  
$134.00   $94.00
- +
1g
95%
in stock  
$335.00   $235.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000912
Chemical Name:
Methyl 3-hydroxy-1-methyl-1h-pyrrole-2-carboxylate
CAS Number:
113602-62-3
Molecular Formula:
C7H9NO3
Molecular Weight:
155.1513
MDL Number:
MFCD12924083
IUPAC Name:
methyl 3-hydroxy-1-methylpyrrole-2-carboxylate
InChI:
InChI=1S/C7H9NO3/c1-8-4-3-5(9)6(8)7(10)11-2/h3-4,9H,1-2H3
InChI Key:
HJHSYAMEFMNNBD-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(O)ccn1C
Properties
Computed Properties
 
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.058g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
155.153g/mol
Monoisotopic Mass:
155.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

Synonyms
 
Methyl 3-hydroxy-1-methyl-1H-pyrrole-2-carboxylate 
113602-62-3 
MFCD12924083 
AKOS023838773 
ZINC170637629 
DS-7450 
AK162103 
ST24047833 
W-4464 
Z2009851127 
1-Methyl-3-hydroxy-1H-pyrrole-2-carboxylic acid methyl ester 
CID10986477 
methyl 3-hydroxy-1-methylpyrrole-2-carboxylate 
(2Z)-2-(hydroxy-methoxy-methylidene)-1-methyl-pyrrol-3-one 
1H-Pyrrole-2-carboxylic acid, 3-hydroxy-1-methyl-, methyl ester 
ACMC-20mimd 
SCHEMBL9826739 
CTK0G1193 
KS-00000SLM 
DTXSID40715989 
HJHSYAMEFMNNBD-UHFFFAOYSA-N 
Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info:
Q & A