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881037-88-3 | 9(10H)-Acridinone, 2-bromo-10-(3-chloropropyl)-
CAS No: 881037-88-3 Catalog No: AG004EAE MDL No:
Product Description
Catalog Number:
AG004EAE
Chemical Name:
9(10H)-Acridinone, 2-bromo-10-(3-chloropropyl)-
CAS Number:
881037-88-3
Molecular Formula:
C16H13BrClNO
Molecular Weight:
350.6375
IUPAC Name:
2-bromo-10-(3-chloropropyl)acridin-9-one
InChI:
InChI=1S/C16H13BrClNO/c17-11-6-7-15-13(10-11)16(20)12-4-1-2-5-14(12)19(15)9-3-8-18/h1-2,4-7,10H,3,8-9H2
InChI Key:
KSXQAUVJMXVHOO-UHFFFAOYSA-N
SMILES:
ClCCCn1c2ccc(cc2c(=O)c2c1cccc2)Br
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.987g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
350.64g/mol
Monoisotopic Mass:
348.987g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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