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71411-84-2 | 1-Heptanol, aluminumsalt (3:1)
CAS No: 71411-84-2 Catalog No: AG005IYQ MDL No:
Product Description
Catalog Number:
AG005IYQ
Chemical Name:
1-Heptanol, aluminumsalt (3:1)
CAS Number:
71411-84-2
Molecular Formula:
C21H45AlO3
Molecular Weight:
372.5617
IUPAC Name:
aluminum;heptan-1-olate
InChI:
InChI=1S/3C7H15O.Al/c3*1-2-3-4-5-6-7-8;/h3*2-7H2,1H3;/q3*-1;+3
InChI Key:
PVNBGPRGXVOOIZ-UHFFFAOYSA-N
SMILES:
[O-]CCCCCCC.[O-]CCCCCCC.[O-]CCCCCCC.[Al+3]
EC Number:
275-390-0
Properties
Complexity:
35.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.318g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
372.57g/mol
Monoisotopic Mass:
372.318g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
69.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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