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13737-38-7 | 9H-Fluorene-1-carboxylic acid, 9-bromo-
CAS No: 13737-38-7 Catalog No: AG00136T MDL No:
Product Description
Catalog Number:
AG00136T
Chemical Name:
9H-Fluorene-1-carboxylic acid, 9-bromo-
CAS Number:
13737-38-7
Molecular Formula:
C14H9BrO2
Molecular Weight:
289.1241
IUPAC Name:
9-bromo-9H-fluorene-1-carboxylic acid
InChI:
InChI=1S/C14H9BrO2/c15-13-10-5-2-1-4-8(10)9-6-3-7-11(12(9)13)14(16)17/h1-7,13H,(H,16,17)
InChI Key:
ZDXPNCHUYBFPAB-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc2c1C(Br)c1c2cccc1
NSC Number:
60831
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.979g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.128g/mol
Monoisotopic Mass:
287.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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