Home Carboxys 2-cyclopropyl-1H-pyrrole-3-carboxylic acid

2-cyclopropyl-1H-pyrrole-3-carboxylic acid

CAS No.:
1484637-07-1
Catalog Number:
AG01B91R
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
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Product Description
Catalog Number:
AG01B91R
Chemical Name:
2-cyclopropyl-1H-pyrrole-3-carboxylic acid
CAS Number:
1484637-07-1
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
MDL Number:
MFCD28383774
IUPAC Name:
2-cyclopropyl-1H-pyrrole-3-carboxylic acid
InChI:
InChI=1S/C8H9NO2/c10-8(11)6-3-4-9-7(6)5-1-2-5/h3-5,9H,1-2H2,(H,10,11)
InChI Key:
XVRQMDZZTUWKKR-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc[nH]c1C1CC1
Properties
Complexity:
177  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
151.165g/mol
Monoisotopic Mass:
151.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties