Home Other Building Blocks 3-(4-(trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride

3-(4-(trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride

CAS No.:
1049697-98-4
Catalog Number:
AG01DX99
Molecular Formula:
C11H13ClF3NO
Molecular Weight:
267.6752
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Product Description
Catalog Number:
AG01DX99
Chemical Name:
3-(4-(trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride
CAS Number:
1049697-98-4
Molecular Formula:
C11H13ClF3NO
Molecular Weight:
267.6752
MDL Number:
MFCD28108770
IUPAC Name:
3-[4-(trifluoromethyl)phenyl]pyrrolidin-3-ol;hydrochloride
InChI:
InChI=1S/C11H12F3NO.ClH/c12-11(13,14)9-3-1-8(2-4-9)10(16)5-6-15-7-10;/h1-4,15-16H,5-7H2;1H
InChI Key:
CCMJKBIBIGSUIZ-UHFFFAOYSA-N
SMILES:
OC1(CNCC1)c1ccc(cc1)C(F)(F)F.Cl
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.064g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
267.676g/mol
Monoisotopic Mass:
267.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties