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119529-48-5 | Benzenediazonium, 4-(benzoylamino)-2-chloro-5-methyl-, chloride (1:1)
CAS No: 119529-48-5 Catalog No: AG000IXW MDL No:
Product Description
Catalog Number:
AG000IXW
Chemical Name:
Benzenediazonium, 4-(benzoylamino)-2-chloro-5-methyl-, chloride (1:1)
CAS Number:
119529-48-5
Molecular Formula:
C14H11Cl2N3O
Molecular Weight:
308.1626
IUPAC Name:
4-benzamido-2-chloro-5-methylbenzenediazonium;chloride
InChI:
InChI=1S/C14H10ClN3O.ClH/c1-9-7-13(18-16)11(15)8-12(9)17-14(19)10-5-3-2-4-6-10;/h2-8H,1H3;1H
InChI Key:
WTNHNWIPTMEJCE-UHFFFAOYSA-N
SMILES:
N#[N+]c1cc(C)c(cc1Cl)NC(=O)c1ccccc1.[Cl-]
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.028g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.162g/mol
Monoisotopic Mass:
307.028g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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