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144579-88-4 | Tryptophan, 4,6-dichloro-
CAS No: 144579-88-4 Catalog No: AG001JS8 MDL No:
Product Description
Catalog Number:
AG001JS8
Chemical Name:
Tryptophan, 4,6-dichloro-
CAS Number:
144579-88-4
Molecular Formula:
C11H10Cl2N2O2
Molecular Weight:
273.1153
IUPAC Name:
2-amino-3-(4,6-dichloro-1H-indol-3-yl)propanoic acid
InChI:
InChI=1S/C11H10Cl2N2O2/c12-6-2-7(13)10-5(1-8(14)11(16)17)4-15-9(10)3-6/h2-4,8,15H,1,14H2,(H,16,17)
InChI Key:
XMTVKPLJEYGBSN-UHFFFAOYSA-N
SMILES:
OC(=O)[C@H](Cc1c[nH]c2c1c(Cl)cc(c2)Cl)N
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.012g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
273.113g/mol
Monoisotopic Mass:
272.012g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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