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Home > Bromides > 1315366-78-9
1315366-78-9 | 8-Quinolinecarboxylic acid, 3-bromo-
CAS No: 1315366-78-9 Catalog No: AG000ZCY MDL No:MFCD19382315
Product Description
Catalog Number:
AG000ZCY
Chemical Name:
8-Quinolinecarboxylic acid, 3-bromo-
CAS Number:
1315366-78-9
Molecular Formula:
C10H6BrNO2
Molecular Weight:
252.0641
MDL Number:
MFCD19382315
IUPAC Name:
3-bromoquinoline-8-carboxylic acid
InChI:
InChI=1S/C10H6BrNO2/c11-7-4-6-2-1-3-8(10(13)14)9(6)12-5-7/h1-5H,(H,13,14)
InChI Key:
XJAKYYQAYNQGRG-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1)cccc2C(=O)O
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.958g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.067g/mol
Monoisotopic Mass:
250.958g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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