Home Halogens Trans (+/-) 4-(2-chlorophenyl)pyrrolidine-3-methylcarboxylate, HCl

Trans (+/-) 4-(2-chlorophenyl)pyrrolidine-3-methylcarboxylate, HCl

CAS No.:
1212327-46-2
Catalog Number:
AG01DM3D
Molecular Formula:
C12H15Cl2NO2
Molecular Weight:
276.1590
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$173
- +
1g
95%
1 week
United States
$377
- +
5g
95%
1 week
United States
$1224
- +
Product Description
Catalog Number:
AG01DM3D
Chemical Name:
Trans (+/-) 4-(2-chlorophenyl)pyrrolidine-3-methylcarboxylate, HCl
CAS Number:
1212327-46-2
Molecular Formula:
C12H15Cl2NO2
Molecular Weight:
276.1590
MDL Number:
MFCD03840069
IUPAC Name:
methyl (3S)-4-(2-chlorophenyl)pyrrolidine-3-carboxylate;hydrochloride
InChI:
InChI=1S/C12H14ClNO2.ClH/c1-16-12(15)10-7-14-6-9(10)8-4-2-3-5-11(8)13;/h2-5,9-10,14H,6-7H2,1H3;1H/t9?,10-;/m1./s1
InChI Key:
GPSAQXGZGMSPEQ-FJYJDOHQSA-N
SMILES:
COC(=O)[C@@H]1CNC[C@H]1c1ccccc1Cl.Cl
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
275.048g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
276.157g/mol
Monoisotopic Mass:
275.048g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties