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Home > Indoles and Oxindole > 1217619-32-3
1217619-32-3 | ent-Calindol-13C,d2Hydrochloride
CAS No: 1217619-32-3 Catalog No: AG01E09L MDL No:
Product Description
Catalog Number:
AG01E09L
Chemical Name:
ent-Calindol-13C,d2Hydrochloride
CAS Number:
1217619-32-3
IUPAC Name:
(1S)-N-[dideuterio(1H-indol-2-yl)(113C)methyl]-1-naphthalen-1-ylethanamine;hydrochloride
InChI:
InChI=1S/C21H20N2.ClH/c1-15(19-11-6-9-16-7-2-4-10-20(16)19)22-14-18-13-17-8-3-5-12-21(17)23-18;/h2-13,15,22-23H,14H2,1H3;1H/t15-;/m0./s1/i14+1D2;
InChI Key:
KFILKQPBQZIRST-XKBPQDPTSA-N
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
339.155g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
3
Molecular Weight:
339.868g/mol
Monoisotopic Mass:
339.155g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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