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88443-87-2 | Pentanedioic acid, 3-(10-cyclohexyldecyl)-3-hydroxy-
CAS No: 88443-87-2 Catalog No: AG004EN1 MDL No:
Product Description
Catalog Number:
AG004EN1
Chemical Name:
Pentanedioic acid, 3-(10-cyclohexyldecyl)-3-hydroxy-
CAS Number:
88443-87-2
Molecular Formula:
C21H38O5
Molecular Weight:
370.5234
IUPAC Name:
3-(10-cyclohexyldecyl)-3-hydroxypentanedioic acid
InChI:
InChI=1S/C21H38O5/c22-19(23)16-21(26,17-20(24)25)15-11-6-4-2-1-3-5-8-12-18-13-9-7-10-14-18/h18,26H,1-17H2,(H,22,23)(H,24,25)
InChI Key:
QRPVDRJTGLORNQ-UHFFFAOYSA-N
SMILES:
OC(=O)CC(CC(=O)O)(CCCCCCCCCCC1CCCCC1)O
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.272g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
370.53g/mol
Monoisotopic Mass:
370.272g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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