methyl (2R)-3-bromo-2-methylpropanoate

methyl (2R)-3-bromo-2-methylpropanoate

CAS: 110556-33-7

Formula: C5H9BrO2

SMILES: COC(=O)[C@@H](C)CBr

IUPAC: methyl (2R)-3-bromo-2-methylpropanoate

InChI: InChI=1S/C5H9BrO2/c1-4(3-6)5(7)8-2/h4H,3H2,1-2H3/t4-/m0/s1

Composition: C (33.17%), H (5.01%), Br (44.14%), O (17.68%)

Molar Mass: 181.029

Atom Count: 17

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	179.978593
Formal Charge	0
FSP3	0.8
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	FKWNAVCXZSQYTA-BYPYZUCNSA-N
Lipinski's Rule of Five	1
Molar Refractivity	34.42
Topological Polar Surface Area	26.3
Polarizability	13.63
Ring Count	0
Rotatable Bond Count	3

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