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Home > Indoles and Oxindole > 114113-16-5
114113-16-5 | 1H-Indole, 2-methoxy-1-methyl-
CAS No: 114113-16-5 Catalog No: AG000ALI MDL No:MFCD12924797
Product Description
Catalog Number:
AG000ALI
Chemical Name:
1H-Indole, 2-methoxy-1-methyl-
CAS Number:
114113-16-5
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
MDL Number:
MFCD12924797
IUPAC Name:
2-methoxy-1-methylindole
InChI:
InChI=1S/C10H11NO/c1-11-9-6-4-3-5-8(9)7-10(11)12-2/h3-7H,1-2H3
InChI Key:
ADCXVOYRRXVHHF-UHFFFAOYSA-N
SMILES:
COc1cc2c(n1C)cccc2
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
14.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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