Home Carboxys 4-Aminotetrahydrothiopyran-4-carboxylic acid methyl ester HCl

4-Aminotetrahydrothiopyran-4-carboxylic acid methyl ester HCl

CAS No.:
161315-14-6
Catalog Number:
AG00B9G3
Molecular Formula:
C7H14ClNO2S
Molecular Weight:
211.7096
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00B9G3
Chemical Name:
4-Aminotetrahydrothiopyran-4-carboxylic acid methyl ester HCl
CAS Number:
161315-14-6
Molecular Formula:
C7H14ClNO2S
Molecular Weight:
211.7096
MDL Number:
MFCD09608000
IUPAC Name:
methyl 4-aminothiane-4-carboxylate;hydrochloride
InChI:
InChI=1S/C7H13NO2S.ClH/c1-10-6(9)7(8)2-4-11-5-3-7;/h2-5,8H2,1H3;1H
InChI Key:
YPSZVCJOAQFOAM-UHFFFAOYSA-N
SMILES:
COC(=O)C1(N)CCSCC1.Cl
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.043g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.704g/mol
Monoisotopic Mass:
211.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties