4-Bromoisoquinoline
CAS: 1532-97-4
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Purity: 99.00%
Ideal for Discovery & Screening This is for information only — not enforced.
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Cas_Number:
1532-97-4
Smiles:
CC(=O)OC(C)(C)CC1=CC=CC=C1
Tpsa:
26.3
Inchi:
InChI=1S/C12H16O2/c1-10(13)14-12(2,3)9-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
Xlogp:
2.7
Inchikey:
FLUWAIIVLCVEKF-UHFFFAOYSA-N
Unit Price:
32.2
Data_Source:
pubchem
Pubchem_Cid:
9024
Heavy_Atom_Count:
14
Molecular_Weight:
192.25
Molecular_Formula:
C12H16O2
Connectivity_Smiles:
CC(=O)OC(C)(C)CC1=CC=CC=C1
Hbond_Acceptor_Count:
2
Rotatable_Bond_Count:
4
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