Home Aldehydes 1H-Pyrrole-2-carboxaldehyde, 1-propyl-

1H-Pyrrole-2-carboxaldehyde, 1-propyl-

CAS No.:
89686-22-6
Catalog Number:
AG0042XM
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
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Product Description
Catalog Number:
AG0042XM
Chemical Name:
1H-Pyrrole-2-carboxaldehyde, 1-propyl-
CAS Number:
89686-22-6
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
MDL Number:
MFCD07364519
IUPAC Name:
1-propylpyrrole-2-carbaldehyde
InChI:
InChI=1S/C8H11NO/c1-2-5-9-6-3-4-8(9)7-10/h3-4,6-7H,2,5H2,1H3
InChI Key:
ZJVXXKFZMHRLLH-UHFFFAOYSA-N
SMILES:
CCCn1cccc1C=O
Properties
Complexity:
114  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.182g/mol
Monoisotopic Mass:
137.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties