Home Aminos methyl 3-[(2-amino-1,3-thiazol-5-yl)methyl]benzoate hydrochloride

methyl 3-[(2-amino-1,3-thiazol-5-yl)methyl]benzoate hydrochloride

CAS No.:
1235440-80-8
Catalog Number:
AG01A8RA
Molecular Formula:
C12H13ClN2O2S
Molecular Weight:
284.7618
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Product Description
Catalog Number:
AG01A8RA
Chemical Name:
methyl 3-[(2-amino-1,3-thiazol-5-yl)methyl]benzoate hydrochloride
CAS Number:
1235440-80-8
Molecular Formula:
C12H13ClN2O2S
Molecular Weight:
284.7618
MDL Number:
MFCD16040159
IUPAC Name:
methyl 3-[(2-amino-1,3-thiazol-5-yl)methyl]benzoate;hydrochloride
InChI:
InChI=1S/C12H12N2O2S.ClH/c1-16-11(15)9-4-2-3-8(5-9)6-10-7-14-12(13)17-10;/h2-5,7H,6H2,1H3,(H2,13,14);1H
InChI Key:
RRNSYZKCYAQTLJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)Cc1cnc(s1)N.Cl
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.039g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.758g/mol
Monoisotopic Mass:
284.039g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties