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923282-39-7

923282-39-7 | 7-Chloro-1-methyl-1H-pyrazolo[4,3-d]pyrimidine

CAS No: 923282-39-7 Catalog No: AG0038JE MDL No:MFCD10000618

Product Description

Catalog Number:
AG0038JE
Chemical Name:
7-Chloro-1-methyl-1H-pyrazolo[4,3-d]pyrimidine
CAS Number:
923282-39-7
Molecular Formula:
C6H5ClN4
Molecular Weight:
168.5837
MDL Number:
MFCD10000618
IUPAC Name:
7-chloro-1-methylpyrazolo[4,3-d]pyrimidine
InChI:
InChI=1S/C6H5ClN4/c1-11-5-4(2-10-11)8-3-9-6(5)7/h2-3H,1H3
InChI Key:
SNAXHGFEBGMQMG-UHFFFAOYSA-N
SMILES:
Cn1ncc2c1c(Cl)ncn2

Properties

Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.584g/mol
Monoisotopic Mass:
168.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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