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123335-34-2 | 9H-Fluorene-2-acetic acid, 9-(hydroxymethyl)-
CAS No: 123335-34-2 Catalog No: AG000KE5 MDL No:
Product Description
Catalog Number:
AG000KE5
Chemical Name:
9H-Fluorene-2-acetic acid, 9-(hydroxymethyl)-
CAS Number:
123335-34-2
Molecular Formula:
C16H14O3
Molecular Weight:
254.2806
IUPAC Name:
2-[9-(hydroxymethyl)-9H-fluoren-2-yl]acetic acid
InChI:
InChI=1S/C16H14O3/c17-9-15-12-4-2-1-3-11(12)13-6-5-10(7-14(13)15)8-16(18)19/h1-7,15,17H,8-9H2,(H,18,19)
InChI Key:
OOXYJXJJWWJVLW-UHFFFAOYSA-N
SMILES:
OCC1c2cc(ccc2c2c1cccc2)CC(=O)O
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.094g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.285g/mol
Monoisotopic Mass:
254.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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