AG00DADN

Name: 5-Bromo-2-(isopropylthio)pyrimidine
Brand: Angene Chemical
SKU: AG00DADN

433684-22-1 | 5-Bromo-2-(isopropylthio)pyrimidine

AG00DADN

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CAS Number	433684-22-1
Catalog Number	AG00DADN
Chemical Name	5-Bromo-2-(isopropylthio)pyrimidine
IUPAC Name	5-bromo-2-propan-2-ylsulfanylpyrimidine
InChI	InChI=1S/C7H9BrN2S/c1-5(2)11-7-9-3-6(8)4-10-7/h3-5H,1-2H3
InChI Key	PCQRYZDHZZKNBI-UHFFFAOYSA-N
MDL Number	MFCD13188494
Molecular Formula	C7H9BrN2S
Molecular Weight	233.1288
SMILES	CC(Sc1ncc(cn1)Br)C
Synonyms	5-Bromo-2-(isopropylthio)pyrimidine, 433684-22-1, ACMC-209ju3, SCHEMBL5644305, CTK4I7276, DTXSID40680704, ANW-29977, MFCD13188494, ZINC40544533, AKOS013182011, 5-bromo-2-(propan-2-ylsulfanyl)pyrimidine, TR-036800, V5943, 5-Bromo-2-[(propan-2-yl)sulfanyl]pyrimidine, K-8906, Pyrimidine, 5-bromo-2-[(1-methylethyl)thio]-, C7H9BrN2S,

Complexity	113
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	231.967g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	233.127g/mol
Monoisotopic Mass	231.967g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	51.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited