Structure

CHEMBRDG-BB 4022158

CAS
915920-24-0
Catalog Number
ACM915920240
Category
Other Products
Molecular Formula
C9H12N2OS

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Specification

Synonyms
CHEMBRDG-BB 4022158;2-(SEC-BUTYLTHIO)PYRIMIDINE-5-CARBALDEHYDE
What is the molecular formula of CHEMBRDG-BB 4022158?

The molecular formula of CHEMBRDG-BB 4022158 is C9H12N2OS.

What is the molecular weight of CHEMBRDG-BB 4022158?

The molecular weight of CHEMBRDG-BB 4022158 is 196.27 g/mol.

What is the IUPAC name of CHEMBRDG-BB 4022158?

The IUPAC name of CHEMBRDG-BB 4022158 is 2-butan-2-ylsulfanylpyrimidine-5-carbaldehyde.

What is the InChI of CHEMBRDG-BB 4022158?

The InChI of CHEMBRDG-BB 4022158 is InChI=1S/C9H12N2OS/c1-3-7(2)13-9-10-4-8(6-12)5-11-9/h4-7H,3H2,1-2H3.

What is the InChIKey of CHEMBRDG-BB 4022158?

The InChIKey of CHEMBRDG-BB 4022158 is NPHSORTVIACXRD-UHFFFAOYSA-N.

What is the Canonical SMILES of CHEMBRDG-BB 4022158?

The Canonical SMILES of CHEMBRDG-BB 4022158 is CCC(C)SC1=NC=C(C=N1)C=O.

What is the CAS number of CHEMBRDG-BB 4022158?

The CAS number of CHEMBRDG-BB 4022158 is 915920-24-0.

What is the XLogP3-AA value of CHEMBRDG-BB 4022158?

The XLogP3-AA value of CHEMBRDG-BB 4022158 is 1.8.

How many hydrogen bond acceptors does CHEMBRDG-BB 4022158 have?

CHEMBRDG-BB 4022158 has 4 hydrogen bond acceptors.

Does CHEMBRDG-BB 4022158 have any defined bond stereocenter count?

No, CHEMBRDG-BB 4022158 does not have any defined bond stereocenter count.

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