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138469-77-9

138469-77-9 | 5-methoxy-3-propyl-1H-indole

CAS No: 138469-77-9 Catalog No: AG01BIAG MDL No:MFCD20667049

Product Description

Catalog Number:
AG01BIAG
Chemical Name:
5-methoxy-3-propyl-1H-indole
CAS Number:
138469-77-9
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD20667049
IUPAC Name:
5-methoxy-3-propyl-1H-indole
InChI:
InChI=1S/C12H15NO/c1-3-4-9-8-13-12-6-5-10(14-2)7-11(9)12/h5-8,13H,3-4H2,1-2H3
InChI Key:
VTLVPBNVFYRAFV-UHFFFAOYSA-N
SMILES:
CCCc1c[nH]c2c1cc(OC)cc2

Properties

Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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