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3-(2-bromoethoxy)propanoic acid

3-(2-bromoethoxy)propanoic acid

CAS: 1393330-33-0

Formula: C5H9BrO3

SMILES: OC(=O)CCOCCBr

IUPAC: 3-(2-bromoethoxy)propanoic acid

InChI: InChI=1S/C5H9BrO3/c6-2-4-9-3-1-5(7)8/h1-4H2,(H,7,8)

Composition: C (30.48%), H (4.60%), Br (40.55%), O (24.36%)

Molar Mass: 197.028

Atom Count: 18

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 195.973507
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey REBYHCQUFPLTTH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.12
Topological Polar Surface Area 46.53
Polarizability 14.22
Ring Count 0
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
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