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70671-46-4 | (S)-(-)-2-BROMO-3-HYDROXYPROPANOIC ACID
CAS No: 70671-46-4 Catalog No: AG005GV7 MDL No:MFCD09751078
Product Description
Catalog Number:
AG005GV7
Chemical Name:
(S)-(-)-2-BROMO-3-HYDROXYPROPANOIC ACID
CAS Number:
70671-46-4
Molecular Formula:
C3H5BrO3
Molecular Weight:
168.9740
MDL Number:
MFCD09751078
IUPAC Name:
(2S)-2-bromo-3-hydroxypropanoic acid
InChI:
InChI=1S/C3H5BrO3/c4-2(1-5)3(6)7/h2,5H,1H2,(H,6,7)/t2-/m0/s1
InChI Key:
OIODSHQRJGRDLE-REOHCLBHSA-N
SMILES:
OC[C@@H](C(=O)O)Br
Properties
Complexity:
72.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
167.942g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.974g/mol
Monoisotopic Mass:
167.942g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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