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35120-18-4 | 1-Bromocyclobutanecarboxylic acid ethyl ester
CAS No: 35120-18-4 Catalog No: AG0032Q3 MDL No:MFCD00001322
Product Description
Catalog Number:
AG0032Q3
Chemical Name:
1-Bromocyclobutanecarboxylic acid ethyl ester
CAS Number:
35120-18-4
Molecular Formula:
C7H11BrO2
Molecular Weight:
207.0650
MDL Number:
MFCD00001322
IUPAC Name:
ethyl 1-bromocyclobutane-1-carboxylate
InChI:
InChI=1S/C7H11BrO2/c1-2-10-6(9)7(8)4-3-5-7/h2-5H2,1H3
InChI Key:
UTVNSHXHFRIXMM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(Br)CCC1
EC Number:
252-384-6
NSC Number:
135010
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.994g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.067g/mol
Monoisotopic Mass:
205.994g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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