Home Aminos (S)-Methyl 3-(1-amino-2-hydroxyethyl)benzoate hydrochloride

(S)-Methyl 3-(1-amino-2-hydroxyethyl)benzoate hydrochloride

CAS No.:
1391447-69-0
Catalog Number:
AG01DTGC
Molecular Formula:
C10H14ClNO3
Molecular Weight:
231.6761
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Product Description
Catalog Number:
AG01DTGC
Chemical Name:
(S)-Methyl 3-(1-amino-2-hydroxyethyl)benzoate hydrochloride
CAS Number:
1391447-69-0
Molecular Formula:
C10H14ClNO3
Molecular Weight:
231.6761
MDL Number:
MFCD12910849
IUPAC Name:
methyl 3-[(1S)-1-amino-2-hydroxyethyl]benzoate;hydrochloride
InChI:
InChI=1S/C10H13NO3.ClH/c1-14-10(13)8-4-2-3-7(5-8)9(11)6-12;/h2-5,9,12H,6,11H2,1H3;1H/t9-;/m1./s1
InChI Key:
SWIJKZSHJUALNL-SBSPUUFOSA-N
SMILES:
OC[C@H](c1cccc(c1)C(=O)OC)N.Cl
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
231.066g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
231.676g/mol
Monoisotopic Mass:
231.066g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties