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Structure

4-Formamidophenylboronic acid pinacol ester

CAS
480424-94-0
Catalog Number
ACM480424940
Category
Other
Molecular Weight
247.1
Molecular Formula
C13H18BNO3

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Specification

Synonyms
BM083, 4-Formylaminophenylboronic acid pinacol ester, 480424-94-0
IUPAC Name
N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]formamide
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)NC=O
InChI Key
CDYFHMUSLGPPMI-UHFFFAOYSA-N
Boiling Point
403.6ºC at 760mmHg
Melting Point
116.7-118.2ºC
Flash Point
197.9ºC
Density
1.09g/cm³
Exact Mass
247.13800
H-Bond Acceptor
3
H-Bond Donor
1
Safety Description
S26-S36-S37-S39
WGK Germany
3
What is the molecular formula of 4-Formamidophenylboronic acid pinacol ester?

The molecular formula is C13H18BNO3.

What is the molecular weight of 4-Formamidophenylboronic acid pinacol ester?

The molecular weight is 247.10 g/mol.

What is the IUPAC name of 4-Formamidophenylboronic acid pinacol ester?

The IUPAC name is N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]formamide.

What is the InChI of 4-Formamidophenylboronic acid pinacol ester?

The InChI is InChI=1S/C13H18BNO3/c1-12(2)13(3,4)18-14(17-12)10-5-7-11(8-6-10)15-9-16/h5-9H,1-4H3,(H,15,16).

What is the InChIKey of 4-Formamidophenylboronic acid pinacol ester?

The InChIKey is CDYFHMUSLGPPMI-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Formamidophenylboronic acid pinacol ester?

The canonical SMILES is B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)NC=O.

What is the CAS number of 4-Formamidophenylboronic acid pinacol ester?

The CAS number is 480424-94-0.

What is the European Community (EC) number of 4-Formamidophenylboronic acid pinacol ester?

The European Community (EC) number is 941-095-7.

Is 4-Formamidophenylboronic acid pinacol ester a covalently-bonded unit?

Yes, it is a covalently-bonded unit with a count of 1.

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