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Home > Indoles and Oxindole > 89169-57-3
89169-57-3 | CYCLOPENT[B]INDOLE, 1,2,3,4-TETRAHYDRO-7-METHOXY-
CAS No: 89169-57-3 Catalog No: AG00GTVC MDL No:MFCD07778368
Product Description
Catalog Number:
AG00GTVC
Chemical Name:
CYCLOPENT[B]INDOLE, 1,2,3,4-TETRAHYDRO-7-METHOXY-
CAS Number:
89169-57-3
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
MDL Number:
MFCD07778368
IUPAC Name:
7-methoxy-1,2,3,4-tetrahydrocyclopenta[b]indole
InChI:
InChI=1S/C12H13NO/c1-14-8-5-6-12-10(7-8)9-3-2-4-11(9)13-12/h5-7,13H,2-4H2,1H3
InChI Key:
HONJGUSMTAVGKM-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c1CCCc1[nH]2
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.242g/mol
Monoisotopic Mass:
187.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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