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methyl 2-azidobenzoate

methyl 2-azidobenzoate

Formula: C8H7N3O2

SMILES: COC(=O)C1=CC=CC=C1N=[N+]=[N-]

IUPAC: methyl 2-azidobenzoate

InChI: InChI=1S/C8H7N3O2/c1-13-8(12)6-4-2-3-5-7(6)10-11-9/h2-5H,1H3

Composition: C (54.24%), H (3.98%), N (23.72%), O (18.06%)

Molar Mass: 177.163

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 177.053826477
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey LGHLODHMWICPLN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.37
Topological Polar Surface Area 55.73
Polarizability 17.03
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C8H7N3O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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