AG00FB42

66127-01-3 | 1,​10-​Phenanthroline, 3-​bromo-

AG00FB42

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CAS Number	66127-01-3
Catalog Number	AG00FB42(AGN-PC-0NC9Z1)
Chemical Name	1,​10-​Phenanthroline, 3-​bromo-
EC Number	613-900-9
IUPAC Name	3-bromo-1,10-phenanthroline
InChI	InChI=1S/C12H7BrN2/c13-10-6-9-4-3-8-2-1-5-14-11(8)12(9)15-7-10/h1-7H
InChI Key	OADZHFGJIVKDJN-UHFFFAOYSA-N
MDL Number	MFCD08276287
Molecular Formula	C12H7BrN2
Molecular Weight	259.1014
SMILES	Brc1cc2c(nc1)c1c(cc2)cccn1
Synonyms	3-bromo-1,10-phenanthroline, 66127-01-3, AK-77019, 3-bromo-phenanthroline, ACMC-209ntq, C12H7BrN2, SCHEMBL913400, 1,10-Phenanthroline,2-bromo-, CTK4E9464, KS-00000NHU, DTXSID20447074, OADZHFGJIVKDJN-UHFFFAOYSA-N, 5815AJ, ANW-35148, MFCD08276287, ZINC34596120, AKOS015899825, CB-2209, CS-W004585, VZ23845, AC-24455, AJ-89626, AN-38561, DS-16938, SC-05945, SY033984, AX8084847, DB-026052, TC-123893, B2632, FT-0646449, MFCD08276287 (97%), A21232, 127B013, I14-11100, 3-Bromophenanthroline, 2-BROMO-1,10-PHENANTHROLINE, CID10887632, 22426-14-8, 3-Bromo-1,10-phenanthroline, 99% - 200MG 200mg,

Complexity	234
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	257.979g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	259.106g/mol
Monoisotopic Mass	257.979g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	25.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number