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36865-40-4 | 1-bromo-3-ethoxypropane
CAS No: 36865-40-4 Catalog No: AG0032PN MDL No:MFCD07780182
Product Description
Catalog Number:
AG0032PN
Chemical Name:
1-bromo-3-ethoxypropane
CAS Number:
36865-40-4
Molecular Formula:
C5H11BrO
Molecular Weight:
167.0442
MDL Number:
MFCD07780182
IUPAC Name:
1-bromo-3-ethoxypropane
InChI:
InChI=1S/C5H11BrO/c1-2-7-5-3-4-6/h2-5H2,1H3
InChI Key:
JOZWPJGRGUOZGY-UHFFFAOYSA-N
SMILES:
BrCCCOCC
NSC Number:
91822
Properties
Complexity:
31.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.999g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.046g/mol
Monoisotopic Mass:
165.999g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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