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927-68-4 | 2-Bromoethyl acetate
CAS No: 927-68-4 Catalog No: AG00336E MDL No:MFCD00000235
Product Description
Catalog Number:
AG00336E
Chemical Name:
2-Bromoethyl acetate
CAS Number:
927-68-4
Molecular Formula:
C4H7BrO2
Molecular Weight:
167.0012
MDL Number:
MFCD00000235
IUPAC Name:
2-bromoethyl acetate
InChI:
InChI=1S/C4H7BrO2/c1-4(6)7-3-2-5/h2-3H2,1H3
InChI Key:
RGHQKFQZGLKBCF-UHFFFAOYSA-N
SMILES:
CC(=O)OCCBr
EC Number:
213-159-8
UNII:
NRZ256O7QB
NSC Number:
7079
Properties
Complexity:
62.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.963g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.002g/mol
Monoisotopic Mass:
165.963g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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