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2-Amino-5-bromo-4-methylnicotinic acid hydrochloride

CAS
59414-89-0
Catalog Number
ACM59414890
Category
Bromine Series
Molecular Weight
267.50762
Molecular Formula
C7H8BrClN2O2

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Specification

Synonyms
2-AMINO-5-BROMO-4-METHYL NICOTINIC ACID HCL;2-AMINO-5-BROMO-4-METHYL NICOTINIC ACID HYDROCHLORIDE
IUPAC Name
2-amino-5-bromo-4-methylpyridine-3-carboxylic acid;hydrochloride
Canonical SMILES
CC1=C(C(=NC=C1Br)N)C(=O)O.Cl
InChI Key
BCISCWGZRSBOHW-UHFFFAOYSA-N
Exact Mass
265.94600
H-Bond Acceptor
4
H-Bond Donor
3
What is the molecular formula of 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride?

The molecular formula is C7H8BrClN2O2.

What is the molecular weight of 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride?

The molecular weight is 267.51 g/mol.

What is the IUPAC name of 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride?

The IUPAC name is 2-amino-5-bromo-4-methylpyridine-3-carboxylic acid;hydrochloride.

What is the InChI of 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride?

The InChI is InChI=1S/C7H7BrN2O2.ClH/c1-3-4(8)2-10-6(9)5(3)7(11)12;/h2H,1H3,(H2,9,10)(H,11,12);1H.

What is the InChIKey of 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride?

The InChIKey is BCISCWGZRSBOHW-UHFFFAOYSA-N.

What is the Canonical SMILES of 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride?

The Canonical SMILES is CC1=C(C(=NC=C1Br)N)C(=O)O.Cl.

What is the CAS number of 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride?

The CAS number is 59414-89-0.

What is the hydrogen bond donor count of 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride?

The hydrogen bond donor count is 3.

What is the hydrogen bond acceptor count of 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride?

The hydrogen bond acceptor count is 4.

Is 2-Amino-5-bromo-4-methylnicotinic acid hydrochloride the canonicalized form?

Yes, it is the canonicalized form.

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