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Home Boronic Acids 1002727-88-9
1002727-88-9,MFCD12028565
Catalog No.:AA0001CL
1002727-88-9 | 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)chroman
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$22.00   $15.00
- +
250mg
97%
in stock  
$29.00   $20.00
- +
1g
95%
in stock  
$98.00   $68.00
- +
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Technical Information
Catalog Number:
AA0001CL
Chemical Name:
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)chroman
CAS Number:
1002727-88-9
Molecular Formula:
C15H21BO3
Molecular Weight:
260.1364
MDL Number:
MFCD12028565
IUPAC Name:
2-(3,4-dihydro-2H-chromen-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C15H21BO3/c1-14(2)15(3,4)19-16(18-14)12-7-8-13-11(10-12)6-5-9-17-13/h7-8,10H,5-6,9H2,1-4H3
InChI Key:
NDSHAELUPJMEBM-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc2c(c1)CCCO2
Properties
Computed Properties
 
Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.158g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.14g/mol
Monoisotopic Mass:
260.158g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1002727-88-9 
2-(Chroman-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 
NDSHAELUPJMEBM-UHFFFAOYSA-N 
ANW-52904 
Chroman-6-boronic acid pinacol ester 
MFCD12028565 
SBB102266 
AKOS015999942 
chroman-6-ylboronic acid pinacol ester 
ZINC169743701 
CS-W021437 
GH-0724 
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)chroman 
RP06321 
AK-94326 
AM802817 
AB0039317 
DB-058338 
TC-141649 
4CH-011804 
FT-0740798 
ST24021863 
Y6765 
2-(3,4-dihydro-2H-1-benzopyran-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 
Q-9111 
J-518008 
3,4-Dihydro-2H-chromene-6-boronic acid, pinacol ester 
2-chroman-6-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 
2H-1-Benzopyran, 3,4-dihydro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- 
3,4-Dihydro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-chromene 
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydro-2H-1-benzopyran 
Chroman-6-boronic acid, pinacol ester 
AMTB667 
SCHEMBL461205 
C15H21BNO3 
CTK3J8718 
DTXSID00656420 
Literature
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