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88904-68-1 | Cyclododecanol, 1-[3-(butylthio)-3-(trimethylsilyl)-2-propenyl]-
CAS No: 88904-68-1 Catalog No: AG00491A MDL No:
Product Description
Catalog Number:
AG00491A
Chemical Name:
Cyclododecanol, 1-[3-(butylthio)-3-(trimethylsilyl)-2-propenyl]-
CAS Number:
88904-68-1
Molecular Formula:
C22H44OSSi
Molecular Weight:
384.7347
IUPAC Name:
1-(3-butylsulfanyl-3-trimethylsilylprop-2-enyl)cyclododecan-1-ol
InChI:
InChI=1S/C22H44OSSi/c1-5-6-20-24-21(25(2,3)4)16-19-22(23)17-14-12-10-8-7-9-11-13-15-18-22/h16,23H,5-15,17-20H2,1-4H3
InChI Key:
SHEHJUHFFCCEOF-UHFFFAOYSA-N
SMILES:
CCCCSC(=CCC1(O)CCCCCCCCCCC1)[Si](C)(C)C
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.288g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
384.738g/mol
Monoisotopic Mass:
384.288g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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