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2091299-50-0 | 4-(7-methyl-1H-indol-3-yl)butan-2-ol
CAS No: 2091299-50-0 Catalog No: AG01BT17 MDL No:MFCD30727550
Product Description
Catalog Number:
AG01BT17
Chemical Name:
4-(7-methyl-1H-indol-3-yl)butan-2-ol
CAS Number:
2091299-50-0
Molecular Formula:
C13H17NO
Molecular Weight:
203.2802
MDL Number:
MFCD30727550
IUPAC Name:
4-(7-methyl-1H-indol-3-yl)butan-2-ol
InChI:
InChI=1S/C13H17NO/c1-9-4-3-5-12-11(7-6-10(2)15)8-14-13(9)12/h3-5,8,10,14-15H,6-7H2,1-2H3
InChI Key:
XHFSKEMDCBRWMO-UHFFFAOYSA-N
SMILES:
CC(CCc1c[nH]c2c1cccc2C)O
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
203.285g/mol
Monoisotopic Mass:
203.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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