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Structure

(9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid

CAS
866100-14-3
Catalog Number
ACM866100143
Category
Boronic Acids
Molecular Weight
281.9g/mol
Molecular Formula
C15H16B2O4

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Specification

Synonyms
BORONIC ACID, (9,9-DIMETHYL-9H-FLUORENE-2,7-DIYL)BIS;(9,9-dimethyl-9H-fluorene-2,7-diyl)bisboronic acid;Boronicacid,(9,9-dimethyl-9H-fluorene-2,7-diyl)b;(9,9-DIMETHYL-9H-FLUOROENE-2,7-DIYL)BISBORONIC ACID;(9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid;
IUPAC Name
(7-borono-9,9-dimethylfluoren-2-yl)boronic acid
Canonical SMILES
B(C1=CC2=C(C=C1)C3=C(C2(C)C)C=C(C=C3)B(O)O)(O)O
InChI
InChI=1S/C15H16B2O4/c1-15(2)13-7-9(16(18)19)3-5-11(13)12-6-4-10(17(20)21)8-14(12)15/h3-8,18-21H,1-2H3
InChI Key
LUVUGOUOAXADNE-UHFFFAOYSA-N
Complexity
354
Covalently-Bonded Unit Count
1
Exact Mass
282.123469g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
4
Heavy Atom Count
21
Monoisotopic Mass
282.123469g/mol
Rotatable Bond Count
2
What is the molecular formula of (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid?

The molecular formula is C15H16B2O4.

What is the molecular weight of (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid?

The molecular weight is 281.9 g/mol.

What is the IUPAC Name of (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid?

The IUPAC name is (7-borono-9,9-dimethylfluoren-2-yl)boronic acid.

What is the InChI of (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid?

The InChI is InChI=1S/C15H16B2O4/c1-15(2)13-7-9(16(18)19)3-5-11(13)12-6-4-10(17(20)21)8-14(12)15/h3-8,18-21H,1-2H3.

What is the InChIKey of (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid?

The InChIKey is LUVUGOUOAXADNE-UHFFFAOYSA-N.

What is the Canonical SMILES of (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid?

The Canonical SMILES is B(C1=CC2=C(C=C1)C3=C(C2(C)C)C=C(C=C3)B(O)O)(O)O.

What is the CAS number of (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid?

The CAS number is 866100-14-3.

What is the EPA DSSTox Substance ID of (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid?

The EPA DSSTox Substance ID is DTXSID70647522.

Is (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid a canonicalized compound?

Yes, (9,9-Dimethyl-9H-fluoren-2,7-diyl)diboronic acid is a canonicalized compound.

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