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Structure

2-Methoxy-1-naphthaleneboronic acid

CAS
104116-17-8
Catalog Number
ACM104116178-1
Category
Boronic Acids
Molecular Weight
202.02g/mol
Molecular Formula
C11H11BO3

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Specification

IUPAC Name
(2-methoxynaphthalen-1-yl)boronic acid
Canonical SMILES
B(C1=C(C=CC2=CC=CC=C12)OC)(O)O
InChI
InChI=1S/C11H11BO3/c1-15-10-7-6-8-4-2-3-5-9(8)11(10)12(13)14/h2-7,13-14H,1H3
InChI Key
NHVWTZOWDLOBBS-UHFFFAOYSA-N
Complexity
210
Covalently-Bonded Unit Count
1
Exact Mass
202.080124g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
15
Monoisotopic Mass
202.080124g/mol
Rotatable Bond Count
2
What is the molecular formula of 2-Methoxy-1-naphthaleneboronic acid?

The molecular formula of 2-Methoxy-1-naphthaleneboronic acid is C11H11BO3.

What is the molecular weight of 2-Methoxy-1-naphthaleneboronic acid?

The molecular weight of 2-Methoxy-1-naphthaleneboronic acid is 202.02 g/mol.

What is the IUPAC name of 2-Methoxy-1-naphthaleneboronic acid?

The IUPAC name of 2-Methoxy-1-naphthaleneboronic acid is (2-methoxynaphthalen-1-yl)boronic acid.

What is the InChI of 2-Methoxy-1-naphthaleneboronic acid?

The InChI of 2-Methoxy-1-naphthaleneboronic acid is InChI=1S/C11H11BO3/c1-15-10-7-6-8-4-2-3-5-9(8)11(10)12(13)14/h2-7,13-14H,1H3.

What is the InChIKey of 2-Methoxy-1-naphthaleneboronic acid?

The InChIKey of 2-Methoxy-1-naphthaleneboronic acid is NHVWTZOWDLOBBS-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Methoxy-1-naphthaleneboronic acid?

The canonical SMILES of 2-Methoxy-1-naphthaleneboronic acid is B(C1=C(C=CC2=CC=CC=C12)OC)(O)O.

What is the CAS number of 2-Methoxy-1-naphthaleneboronic acid?

The CAS number of 2-Methoxy-1-naphthaleneboronic acid is 104116-17-8.

What is the European Community (EC) number of 2-Methoxy-1-naphthaleneboronic acid?

The European Community (EC) number of 2-Methoxy-1-naphthaleneboronic acid is 687-037-1.

What is the DSSTox Substance ID of 2-Methoxy-1-naphthaleneboronic acid?

The DSSTox Substance ID of 2-Methoxy-1-naphthaleneboronic acid is DTXSID00400748.

Is 2-Methoxy-1-naphthaleneboronic acid a canonicalized compound?

Yes, 2-Methoxy-1-naphthaleneboronic acid is a canonicalized compound.

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