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Home > Bromides > 1000529-41-8
1000529-41-8 | 5-Thiazolepropanol, 2-bromo-
CAS No: 1000529-41-8 Catalog No: AG0000PV MDL No:MFCD09927237
Product Description
Catalog Number:
AG0000PV
Chemical Name:
5-Thiazolepropanol, 2-bromo-
CAS Number:
1000529-41-8
Molecular Formula:
C6H8BrNOS
Molecular Weight:
222.1028
MDL Number:
MFCD09927237
IUPAC Name:
3-(2-bromo-1,3-thiazol-5-yl)propan-1-ol
InChI:
InChI=1S/C6H8BrNOS/c7-6-8-4-5(10-6)2-1-3-9/h4,9H,1-3H2
InChI Key:
DNESOJRQUKCCBE-UHFFFAOYSA-N
SMILES:
OCCCc1cnc(s1)Br
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.951g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.1g/mol
Monoisotopic Mass:
220.951g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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