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Home > Aldehydes > 258831-64-0
258831-64-0 | 3-BroMo-4-(2-Morpholinoethoxy)benzaldehyde
CAS No: 258831-64-0 Catalog No: AG00BIBK MDL No:MFCD09719145
Product Description
Catalog Number:
AG00BIBK
Chemical Name:
3-BroMo-4-(2-Morpholinoethoxy)benzaldehyde
CAS Number:
258831-64-0
Molecular Formula:
C13H16BrNO3
Molecular Weight:
314.1750
MDL Number:
MFCD09719145
IUPAC Name:
3-bromo-4-(2-morpholin-4-ylethoxy)benzaldehyde
InChI:
InChI=1S/C13H16BrNO3/c14-12-9-11(10-16)1-2-13(12)18-8-5-15-3-6-17-7-4-15/h1-2,9-10H,3-8H2
InChI Key:
ZCDQEMFDTZRRRD-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)Br)OCCN1CCOCC1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.031g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.179g/mol
Monoisotopic Mass:
313.031g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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