Home Other Building Blocks 2-(5-cyano-2,3-dihydro-1H-indol-3-yl)acetic acid hydrochloride

2-(5-cyano-2,3-dihydro-1H-indol-3-yl)acetic acid hydrochloride

CAS No.:
1955506-78-1
Catalog Number:
AG01B5BW
Molecular Formula:
C11H11ClN2O2
Molecular Weight:
238.6702
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B5BW
Chemical Name:
2-(5-cyano-2,3-dihydro-1H-indol-3-yl)acetic acid hydrochloride
CAS Number:
1955506-78-1
Molecular Formula:
C11H11ClN2O2
Molecular Weight:
238.6702
MDL Number:
MFCD30181028
IUPAC Name:
2-(5-cyano-2,3-dihydro-1H-indol-3-yl)acetic acid;hydrochloride
InChI:
InChI=1S/C11H10N2O2.ClH/c12-5-7-1-2-10-9(3-7)8(6-13-10)4-11(14)15;/h1-3,8,13H,4,6H2,(H,14,15);1H
InChI Key:
AERIXPHUNQZWMY-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CNc2c1cc(cc2)C#N.Cl
Properties
Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
238.671g/mol
Monoisotopic Mass:
238.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
73.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties