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102619-08-9

102619-08-9 | 1H-Pyrrole-1-carboxylic acid, 2-propen-1-yl ester

CAS No: 102619-08-9 Catalog No: AG0007XL MDL No:

Product Description

Catalog Number:
AG0007XL
Chemical Name:
1H-Pyrrole-1-carboxylic acid, 2-propen-1-yl ester
CAS Number:
102619-08-9
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
IUPAC Name:
prop-1-en-2-yl pyrrole-1-carboxylate
InChI:
InChI=1S/C8H9NO2/c1-7(2)11-8(10)9-5-3-4-6-9/h3-6H,1H2,2H3
InChI Key:
ARXLPCMBTZOTAQ-UHFFFAOYSA-N
SMILES:
C=CCOC(=O)n1cccc1

Properties

Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.063g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.165g/mol
Monoisotopic Mass:
151.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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