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182219-43-8,MFCD28898786
Catalog No.:AA0023F6

182219-43-8 | 2-Butanone-1,1,1,3,3-d5, 4-(4-hydroxyphenyl)- (9CI)

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Technical Information
Catalog Number:
AA0023F6
Chemical Name:
2-Butanone-1,1,1,3,3-d5, 4-(4-hydroxyphenyl)- (9CI)
CAS Number:
182219-43-8
Molecular Formula:
C10H7D5O2
Molecular Weight:
169.2319
MDL Number:
MFCD28898786
SMILES:
C([2H])(C(=O)C(Cc1ccc(cc1)O)([2H])[2H])([2H])[2H]
Properties
Properties
 
Form:
Solid  
MP:
>80ºC (dec.)  
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
146  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
5  
Rotatable Bond Count:
3  
XLogP3:
1.5  

Literature
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SDS
Tags:182219-43-8 Molecular Formula|182219-43-8 MDL|182219-43-8 SMILES|182219-43-8 2-Butanone-1,1,1,3,3-d5, 4-(4-hydroxyphenyl)- (9CI)