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1396962-37-0 | 2-{[(2,4-dichlorophenyl)methyl]amino}propanoic acid hydrochloride
CAS No: 1396962-37-0 Catalog No: AG019UNQ MDL No:MFCD11798834
Product Description
Catalog Number:
AG019UNQ
Chemical Name:
2-{[(2,4-dichlorophenyl)methyl]amino}propanoic acid hydrochloride
CAS Number:
1396962-37-0
Molecular Formula:
C10H12Cl3NO2
Molecular Weight:
284.5668
MDL Number:
MFCD11798834
IUPAC Name:
2-[(2,4-dichlorophenyl)methylamino]propanoic acid;hydrochloride
InChI:
InChI=1S/C10H11Cl2NO2.ClH/c1-6(10(14)15)13-5-7-2-3-8(11)4-9(7)12;/h2-4,6,13H,5H2,1H3,(H,14,15);1H
InChI Key:
WESPDAIJFOKLLG-UHFFFAOYSA-N
SMILES:
OC(=O)C(NCc1ccc(cc1Cl)Cl)C.Cl
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.993g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
284.561g/mol
Monoisotopic Mass:
282.993g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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