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121535-91-9 | Benzenediazonium, (2-methyl-1-oxopropyl)-, chloride (9CI)
CAS No: 121535-91-9 Catalog No: AG001596 MDL No:
Product Description
Catalog Number:
AG001596
Chemical Name:
Benzenediazonium, (2-methyl-1-oxopropyl)-, chloride (9CI)
CAS Number:
121535-91-9
Molecular Formula:
C10H11ClN2O
Molecular Weight:
210.6601
IUPAC Name:
2-methyl-3-propanoylbenzenediazonium;chloride
InChI:
InChI=1S/C10H11N2O.ClH/c1-3-10(13)8-5-4-6-9(12-11)7(8)2;/h4-6H,3H2,1-2H3;1H/q+1;/p-1
InChI Key:
WJKXCSBCYRTSNI-UHFFFAOYSA-M
SMILES:
N#[N+]c1ccccc1C(=O)C(C)C.[Cl-]
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.056g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.661g/mol
Monoisotopic Mass:
210.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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