3-Chloro-1-butyne

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Catalog Number
ACM21020246
Product Name
3-Chloro-1-butyne
Structure
Structure
CAS
21020-24-6
Category
Heterocyclic Organic Compound
IUPAC Name
3-chlorobut-1-yne
Molecular Weight
88.53g/mol
Molecular Formula
C4H5Cl
Canonical SMILES
CC(C#C)Cl
InChI
InChI=1S/C4H5Cl/c1-3-4(2)5/h1,4H,2H3
InChI Key
PZFBULOUMNPBFA-UHFFFAOYSA-N
Complexity
57.3
Covalently-Bonded Unit Count
1
EC Number
244-151-2
Exact Mass
88.007978g/mol
Formal Charge
0
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
5
Monoisotopic Mass
88.007978g/mol
Rotatable Bond Count
0
XLogP3
1.3
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