CAS
938458-86-7 Purity
96%
938458-86-7 Purity
96%
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2-Amino-6-isobutylpyrimidine-4-carboxylic acid
CAS
938458-90-3
Catalog Number
ACM938458903
Category
Other Products
Molecular Weight
195.218420 [g/mol]
Molecular Formula
C9H13N3O2
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Specification
Synonyms
2-Amino-6-isobutylpyrimidine-4-carboxylic acid, 938458-90-3, Ambcb4004179, CTK5H3498, MolPort-016-630-892, AKOS006283262, AG-H-84173
IUPAC Name
2-amino-6-(2-methylpropyl)pyrimidine-4-carboxylic acid
SMILES
CC(C)CC1=NC(=NC(=C1)C(=O)O)N
InChI Key
WHKPTEJDEXIZAF-UHFFFAOYSA-N
Boiling Point
437.3ºC at 760 mmHg
Flash Point
218.3ºC
Density
1.244g/cm³
Exact Mass
195.10100
H-Bond Acceptor
5
H-Bond Donor
2
What is the molecular formula of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid?
The molecular formula of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid is C9H13N3O2.
What is the molecular weight of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid?
The molecular weight of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid is 195.22 g/mol.
What is the IUPAC name of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid?
The IUPAC name of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid is 2-amino-6-(2-methylpropyl)pyrimidine-4-carboxylic acid.
What is the InChIKey of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid?
The InChIKey of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid is WHKPTEJDEXIZAF-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 2-Amino-6-isobutylpyrimidine-4-carboxylic acid have?
2-Amino-6-isobutylpyrimidine-4-carboxylic acid has 2 hydrogen bond donor counts.
What is the XLogP3-AA value of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid?
The XLogP3-AA value of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid is 1.3.
Is 2-Amino-6-isobutylpyrimidine-4-carboxylic acid a canonicalized compound?
Yes, 2-Amino-6-isobutylpyrimidine-4-carboxylic acid is a canonicalized compound.
What is the topological polar surface area of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid?
The topological polar surface area of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid is 89.1 Ų.
How many rotatable bond counts does 2-Amino-6-isobutylpyrimidine-4-carboxylic acid have?
2-Amino-6-isobutylpyrimidine-4-carboxylic acid has 3 rotatable bond counts.
What is the complexity value of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid?
The complexity value of 2-Amino-6-isobutylpyrimidine-4-carboxylic acid is 208.
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