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90906-16-4

90906-16-4 | 2-Butyne, 1-(chloromethoxy)-4-methoxy-

CAS No: 90906-16-4 Catalog No: AG006GOJ MDL No:

Product Description

Catalog Number:
AG006GOJ
Chemical Name:
2-Butyne, 1-(chloromethoxy)-4-methoxy-
CAS Number:
90906-16-4
Molecular Formula:
C6H9ClO2
Molecular Weight:
148.5875
IUPAC Name:
1-(chloromethoxy)-4-methoxybut-2-yne
InChI:
InChI=1S/C6H9ClO2/c1-8-4-2-3-5-9-6-7/h4-6H2,1H3
InChI Key:
KNPUTZDXFILYLM-UHFFFAOYSA-N
SMILES:
COCC#CCOCCl

Properties

Complexity:
111  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.029g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.586g/mol
Monoisotopic Mass:
148.029g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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