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24157-02-6 | 4-BROMOBUTYRALDEHYDE DIMETHYLACETAL
CAS No: 24157-02-6 Catalog No: AG00BF8R MDL No:MFCD02262158
Product Description
Catalog Number:
AG00BF8R
Chemical Name:
4-BROMOBUTYRALDEHYDE DIMETHYLACETAL
CAS Number:
24157-02-6
Molecular Formula:
C6H13BrO2
Molecular Weight:
197.0702
MDL Number:
MFCD02262158
IUPAC Name:
4-bromo-1,1-dimethoxybutane
InChI:
InChI=1S/C6H13BrO2/c1-8-6(9-2)4-3-5-7/h6H,3-5H2,1-2H3
InChI Key:
QPNPLSCMVPQSEZ-UHFFFAOYSA-N
SMILES:
BrCCCC(OC)OC
Properties
Complexity:
55
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.01g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.072g/mol
Monoisotopic Mass:
196.01g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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