Home Other Building Blocks 2,2-difluoro-2-(1H-imidazol-2-yl)acetic acid hydrochloride

2,2-difluoro-2-(1H-imidazol-2-yl)acetic acid hydrochloride

CAS No.:
1432679-73-6
Catalog Number:
AG01A4H8
Molecular Formula:
C5H5ClF2N2O2
Molecular Weight:
198.5552
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Product Description
Catalog Number:
AG01A4H8
Chemical Name:
2,2-difluoro-2-(1H-imidazol-2-yl)acetic acid hydrochloride
CAS Number:
1432679-73-6
Molecular Formula:
C5H5ClF2N2O2
Molecular Weight:
198.5552
MDL Number:
MFCD23701879
IUPAC Name:
2,2-difluoro-2-(1H-imidazol-2-yl)acetic acid;hydrochloride
InChI:
InChI=1S/C5H4F2N2O2.ClH/c6-5(7,4(10)11)3-8-1-2-9-3;/h1-2H,(H,8,9)(H,10,11);1H
InChI Key:
XCNCGGJBYVYNBF-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ncc[nH]1)(F)F.Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.001g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
198.554g/mol
Monoisotopic Mass:
198.001g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties