Text Search
Structure Search

2-bromoethyl benzoate

2-bromoethyl benzoate

CAS: 939-54-8

Formula: C9H9BrO2

SMILES: BrCCOC(=O)C1=CC=CC=C1

IUPAC: 2-bromoethyl benzoate

InChI: InChI=1S/C9H9BrO2/c10-6-7-12-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2

Composition: C (47.19%), H (3.96%), Br (34.88%), O (13.97%)

Molar Mass: 229.073

Atom Count: 21

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 227.978593
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey KNBBDZULQFKSIE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.41
Topological Polar Surface Area 26.3
Polarizability 19.34
Ring Count 1
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 939-54-8 $57.97-$585.31$57.97$176.72$585.31
Request Quote
Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <14 Days 939-54-8 Quote Only
Request Quote
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 939-54-8 $7.25-$2,677.55$7.25$9.32$12.42$14.49$62.10$165.60$2,677.55
Request Quote
AA BLOCKS INC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 939-54-8 $18.40$18.40
Request Quote