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Structure

2-bromo-4-ethyl-5-nitropyridine

CAS
929617-28-7
Catalog Number
ACM929617287
Category
Other Products
Molecular Weight
231.046680 [g/mol]
Molecular Formula
C7H7BrN2O2

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Specification

Synonyms
2-bromo-4-ethyl-5-nitropyridine, 929617-28-7, SBB068954, ZINC32914771, 2-bromanyl-4-ethyl-5-nitro-pyridine, AKOS015916899, KB-168971, FT-0654130, A844403, S02-0030
IUPAC Name
2-bromo-4-ethyl-5-nitropyridine
Canonical SMILES
CCC1=CC(=NC=C1[N+](=O)[O-])Br
InChI Key
WPVYXDXNMDQACF-UHFFFAOYSA-N
Exact Mass
229.96900
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 2-bromo-4-ethyl-5-nitropyridine?

The molecular formula of 2-bromo-4-ethyl-5-nitropyridine is C7H7BrN2O2.

When was 2-bromo-4-ethyl-5-nitropyridine created in PubChem?

2-bromo-4-ethyl-5-nitropyridine was created in PubChem on May 30, 2009.

What is the molecular weight of 2-bromo-4-ethyl-5-nitropyridine?

The molecular weight of 2-bromo-4-ethyl-5-nitropyridine is 231.05 g/mol.

What is the InChIKey of 2-bromo-4-ethyl-5-nitropyridine?

The InChIKey of 2-bromo-4-ethyl-5-nitropyridine is WPVYXDXNMDQACF-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does 2-bromo-4-ethyl-5-nitropyridine have?

2-bromo-4-ethyl-5-nitropyridine has 3 hydrogen bond acceptor counts.

What is the topological polar surface area of 2-bromo-4-ethyl-5-nitropyridine?

The topological polar surface area of 2-bromo-4-ethyl-5-nitropyridine is 58.7 Ų.

Is 2-bromo-4-ethyl-5-nitropyridine a canonicalized compound?

Yes, 2-bromo-4-ethyl-5-nitropyridine is a canonicalized compound according to PubChem.

How many rotatable bonds does 2-bromo-4-ethyl-5-nitropyridine have?

2-bromo-4-ethyl-5-nitropyridine has 1 rotatable bond.

What is the exact mass of 2-bromo-4-ethyl-5-nitropyridine?

The exact mass of 2-bromo-4-ethyl-5-nitropyridine is 229.96909 g/mol.

What is the complexity value of 2-bromo-4-ethyl-5-nitropyridine?

The complexity value of 2-bromo-4-ethyl-5-nitropyridine is 171.

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