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2568-90-3 | FORMALDEHYDE DI-N-BUTYL ACETAL
CAS No: 2568-90-3 Catalog No: AG003QOL MDL No:MFCD00059270
Product Description
Catalog Number:
AG003QOL
Chemical Name:
FORMALDEHYDE DI-N-BUTYL ACETAL
CAS Number:
2568-90-3
Molecular Formula:
C9H20O2
Molecular Weight:
160.2539
MDL Number:
MFCD00059270
IUPAC Name:
1-(butoxymethoxy)butane
InChI:
InChI=1S/C9H20O2/c1-3-5-7-10-9-11-8-6-4-2/h3-9H2,1-2H3
InChI Key:
QLCJOAMJPCOIDI-UHFFFAOYSA-N
SMILES:
CCCCOCOCCCC
EC Number:
219-909-0
UNII:
V5WWR58LDU
NSC Number:
241
Properties
Complexity:
56.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.146g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.257g/mol
Monoisotopic Mass:
160.146g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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