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12-Mercaptododecanoic acid

Catalog Number
ACM82001534
Product Name
12-Mercaptododecanoic acid
Structure
CAS
82001-53-4
Category
Self-Assembly Materials
Synonyms
12-Mercaptododecanoic acid ,97%;12-Mercaptododecanoic acid 96%
IUPAC Name
12-sulfanyldodecanoic acid
Molecular Weight
232.38g/mol
Molecular Formula
C12H24O2S
Canonical SMILES
C(CCCCCC(=O)O)CCCCCS
InChI
InChI=1S/C12H24O2S/c13-12(14)10-8-6-4-2-1-3-5-7-9-11-15/h15H,1-11H2,(H,13,14)
InChI Key
SDAWVOFJSUUKMR-UHFFFAOYSA-N
Complexity
149
Covalently-Bonded Unit Count
1
Exact Mass
232.149701g/mol
Formal Charge
0
Heavy Atom Count
15
Monoisotopic Mass
232.149701g/mol
Rotatable Bond Count
11
XLogP3
4.6
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