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Home Aldehydes 5-Methyl-1h-pyrrole-2-carbaldehyde

5-Methyl-1h-pyrrole-2-carbaldehyde

CAS No.:
1192-79-6
Catalog Number:
AG000IC8
Molecular Formula:
C6H7NO
Molecular Weight:
109.1259
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$34
- +
250mg
95%
In Stock USA
United States
$53
- +
1g
95%
In Stock USA
United States
$125
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG000IC8
Chemical Name:
5-Methyl-1h-pyrrole-2-carbaldehyde
CAS Number:
1192-79-6
Molecular Formula:
C6H7NO
Molecular Weight:
109.1259
MDL Number:
MFCD08236773
IUPAC Name:
5-methyl-1H-pyrrole-2-carbaldehyde
InChI:
InChI=1S/C6H7NO/c1-5-2-3-6(4-8)7-5/h2-4,7H,1H3
InChI Key:
LFWLUDLUCDRDAF-UHFFFAOYSA-N
SMILES:
Cc1ccc([nH]1)C=O
UNII:
SP16VW48RI
NSC Number:
81349
Properties
Complexity:
92.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.053g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
109.128g/mol
Monoisotopic Mass:
109.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Chemoenzymatic formation of novel aminocoumarin antibiotics by the enzymes CouN1 and CouN7. Biochemistry 20070717
Installation of the pyrrolyl-2-carboxyl pharmacophore by CouN1 and CouN7 in the late biosynthetic steps of the aminocoumarin antibiotics clorobiocin and coumermycin A1. Biochemistry 20060718
Metabolic engineering of aminocoumarins: inactivation of the methyltransferase gene cloP and generation of new clorobiocin derivatives in a heterologous host. Chembiochem : a European journal of chemical biology 20050801
Properties