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101533-94-2 | 2-Pentyne, 5-(methoxymethoxy)-
CAS No: 101533-94-2 Catalog No: AG0004QA MDL No:
Product Description
Catalog Number:
AG0004QA
Chemical Name:
2-Pentyne, 5-(methoxymethoxy)-
CAS Number:
101533-94-2
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
IUPAC Name:
5-(methoxymethoxy)pent-2-yne
InChI:
InChI=1S/C7H12O2/c1-3-4-5-6-9-7-8-2/h5-7H2,1-2H3
InChI Key:
RGJXNGZGCGSZQI-UHFFFAOYSA-N
SMILES:
COCOCCC#CC
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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