Home Other Building Blocks Trans-4-(3-methylbenzyl)-l-proline HCl

Trans-4-(3-methylbenzyl)-l-proline HCl

CAS No.:
1049734-52-2
Catalog Number:
AG0094YB
Molecular Formula:
C13H18ClNO2
Molecular Weight:
255.7405
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 98% (TLC)
1 week
United States
$140
- +
250mg
≥ 98% (TLC)
1 week
United States
$243
- +
Product Description
Catalog Number:
AG0094YB
Chemical Name:
Trans-4-(3-methylbenzyl)-l-proline HCl
CAS Number:
1049734-52-2
Molecular Formula:
C13H18ClNO2
Molecular Weight:
255.7405
MDL Number:
MFCD06659406
IUPAC Name:
(2S,4R)-4-[(3-methylphenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C13H17NO2.ClH/c1-9-3-2-4-10(5-9)6-11-7-12(13(15)16)14-8-11;/h2-5,11-12,14H,6-8H2,1H3,(H,15,16);1H/t11-,12+;/m1./s1
InChI Key:
WIVWVXAUZPVBHO-LYCTWNKOSA-N
SMILES:
OC(=O)[C@H]1NC[C@@H](C1)Cc1cccc(c1)C.Cl
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
255.103g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
255.742g/mol
Monoisotopic Mass:
255.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties