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1260795-57-0 | 1H-Indole, 3-(2-chloroethyl)-4-methoxy-
CAS No: 1260795-57-0 Catalog No: AG000RAQ MDL No:
Product Description
Catalog Number:
AG000RAQ
Chemical Name:
1H-Indole, 3-(2-chloroethyl)-4-methoxy-
CAS Number:
1260795-57-0
Molecular Formula:
C11H12ClNO
Molecular Weight:
209.6721
IUPAC Name:
3-(2-chloroethyl)-4-methoxy-1H-indole
InChI:
InChI=1S/C11H12ClNO/c1-14-10-4-2-3-9-11(10)8(5-6-12)7-13-9/h2-4,7,13H,5-6H2,1H3
InChI Key:
ACLLCZPZFUHFGZ-UHFFFAOYSA-N
SMILES:
ClCCc1c[nH]c2c1c(OC)ccc2
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.061g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.673g/mol
Monoisotopic Mass:
209.061g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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