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Meso-1,2,3,4-tetrabromobutane

Catalog Number
ACM2657672-1
CAS Number
2657-67-2
Product Name
Meso-1,2,3,4-tetrabromobutane
Structure
Category
Plastic Additives
Synonyms
(2R,3S)-1,2,3,4-Tetrabromobutane
IUPAC Name
(2S,3R)-1,2,3,4-Tetrabromobutane
Molecular Weight
373.71
Molecular Formula
C4H6Br4
Canonical SMILES
C(C(C(CBr)Br)Br)Br
InChI
InChI=1S/C4H6Br4/c5-1-3(7)4(8)2-6/h3-4H,1-2H2/t3-,4+
InChI Key
HGRZLIGHKHRTRE-ZXZARUISSA-N
Boiling Point
181 °C
Melting Point
116 °C
Purity
98%+
Complexity
48
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Defined Bond Stereocenter Count
0
Exact Mass
373.7162
Formal Charge
0
Heavy Atom Count
8
Hydrogen Bond Acceptor Count
0
Hydrogen Bond Donor Count
0
Isomeric SMILES
C([C@H]([C@H](CBr)Br)Br)Br
Isotope Atom Count
0
Monoisotopic Mass
369.7203
Rotatable Bond Count
3
Topological Polar Surface Area
0 Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
3.4
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