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19184-65-7 | 1,3-Propanediol, 2-(bromomethyl)-2-(hydroxymethyl)-
CAS No: 19184-65-7 Catalog No: AG002FHY MDL No:MFCD00135306
Product Description
Catalog Number:
AG002FHY
Chemical Name:
1,3-Propanediol, 2-(bromomethyl)-2-(hydroxymethyl)-
CAS Number:
19184-65-7
Molecular Formula:
C5H11BrO3
Molecular Weight:
199.0430
MDL Number:
MFCD00135306
IUPAC Name:
2-(bromomethyl)-2-(hydroxymethyl)propane-1,3-diol
InChI:
InChI=1S/C5H11BrO3/c6-1-5(2-7,3-8)4-9/h7-9H,1-4H2
InChI Key:
MMHHBAUIJVTLFZ-UHFFFAOYSA-N
SMILES:
OCC(CBr)(CO)CO
EC Number:
242-863-8
NSC Number:
151735
Properties
Complexity:
64.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.989g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
199.044g/mol
Monoisotopic Mass:
197.989g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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