Home Other Building Blocks METHYL (3R)-3-AMINO-3-(3,4-DICHLOROPHENYL)PROPANOATE HYDROCHLORIDE

METHYL (3R)-3-AMINO-3-(3,4-DICHLOROPHENYL)PROPANOATE HYDROCHLORIDE

CAS No.:
2097958-02-4
Catalog Number:
AG01DU6J
Molecular Formula:
C10H12Cl3NO2
Molecular Weight:
284.5668
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Product Description
Catalog Number:
AG01DU6J
Chemical Name:
METHYL (3R)-3-AMINO-3-(3,4-DICHLOROPHENYL)PROPANOATE HYDROCHLORIDE
CAS Number:
2097958-02-4
Molecular Formula:
C10H12Cl3NO2
Molecular Weight:
284.5668
MDL Number:
MFCD24413313
IUPAC Name:
methyl 3-amino-3-(3,4-dichlorophenyl)propanoate;hydrochloride
InChI:
InChI=1S/C10H11Cl2NO2.ClH/c1-15-10(14)5-9(13)6-2-3-7(11)8(12)4-6;/h2-4,9H,5,13H2,1H3;1H
InChI Key:
DJSSFGWNYRSXFO-UHFFFAOYSA-N
SMILES:
COC(=O)C[C@H](c1ccc(c(c1)Cl)Cl)N.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:
2  
Isotope Atom Count:
0
Molecular Weight:
284.561g/mol
Monoisotopic Mass:
282.993g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties