Home Other Building Blocks methyl 2-(2-formyl-1H-pyrrol-1-yl)propanoate

methyl 2-(2-formyl-1H-pyrrol-1-yl)propanoate

CAS No.:
60026-29-1
Catalog Number:
AG01A4KU
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A4KU
Chemical Name:
methyl 2-(2-formyl-1H-pyrrol-1-yl)propanoate
CAS Number:
60026-29-1
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD11909483
IUPAC Name:
methyl 2-(2-formylpyrrol-1-yl)propanoate
InChI:
InChI=1S/C9H11NO3/c1-7(9(12)13-2)10-5-3-4-8(10)6-11/h3-7H,1-2H3
InChI Key:
YAAGUYBVQGYYSD-UHFFFAOYSA-N
SMILES:
COC(=O)C(n1cccc1C=O)C
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.191g/mol
Monoisotopic Mass:
181.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties