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Home > Indoles and Oxindole > 83363-32-0
83363-32-0 | 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2
CAS No: 83363-32-0 Catalog No: AG00GDO5 MDL No:
Product Description
Catalog Number:
AG00GDO5
Chemical Name:
1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2
CAS Number:
83363-32-0
IUPAC Name:
(E)-but-2-enedioic acid;4-(1-methylpiperidin-3-yl)-1H-indole
InChI:
InChI=1S/2C14H18N2.C4H4O4/c2*1-16-9-3-4-11(10-16)12-5-2-6-14-13(12)7-8-15-14;5-3(6)1-2-4(7)8/h2*2,5-8,11,15H,3-4,9-10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+
InChI Key:
LVCIZVOLHLNGJR-WXXKFALUSA-N
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
544.305g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
544.696g/mol
Monoisotopic Mass:
544.305g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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