2,5-diphenylpyrimidine

CAT: 1731-AQ NN 0290-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:1731-AQ NN 0290-01Size:1 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

29134-16-5

MDL Number

MFCD00204390

Purity

0.95

Smiles

C1ccc (-c2cnc (-c3ccccc3) nc2) cc1

Shipping Conditions

Room temperature, no cold chain required

Chemical Information

2,5-Diphenylpyrimidine

CAS Number	29134-16-5
PubChem CID	755305
IUPAC Name	2,5-diphenylpyrimidine
Molecular Formula	C16H12N2
Molecular Weight	232.28
XLogP	3.5
Topological Polar Surface Area	25.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	18
Formal Charge	0
Complexity	233

SMILES

C1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H12N2/c1-3-7-13(8-4-1)15-11-17-16(18-12-15)14-9-5-2-6-10-14/h1-12H

InChIKey

HEYRZXKTUUUXKL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 29134-16-5

CID: 755305

Formula: C16H12N2

MW: 232.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	232.28
XLogP3	3.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	232.100048391
Monoisotopic Mass	232.100048391
Topological Polar Surface Area	25.8 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	233
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AQ NN 0177-01	2,3-diphenylpyridine
AQ A2 0030-01	2,2,5,5-tetramethylhexan-3-one
AQ A1 0021-01	2,2,3,5,5-pentamethylhexan-3-ol
AP KN 0203-01	2,5-dimethylhex-3-yne-2,5-diol
FH 1W 0050-01	2,5-dibromophenol
FH 1W 0043-01	2,5-dibromoaniline
GT SW 0579-01	2- (2-aminoethyl) -5-bromophenol
AL FB 0050-01	2- (4-fluorophenyl) -4,6-diphenylpyridine
AL BE 0347-01	5- (5-thiophen-2-ylthiophen-2-yl) thiophene-2-carboxylic acid
AQ A1 0038-01	(5-azaniumyl-2,5-dimethylhexan-2-yl) azanium diperchlorate

Catalog	Name
OR1060870-01	2,5-Diphenylpyrimidine
OR1100107-01	2,4-Diphenylpyrimidine
sc-233083	4,6-Dichloro-2,5-diphenylpyrimidine
OR96351-01	4- (3,5-Dibromophenyl) -2,6-diphenylpyrimidine
OR96042-01	2-Chloro-4,6-diphenylpyrimidine
OR1055682-01	2-Methyl-4,6-diphenylpyrimidine
OR1065775-01	4-Methyl-2,6-diphenylpyrimidine
OR89666-01	4-Chloro-2,6-diphenylpyrimidine
OR1011114-01	4- (3-Bromo-5-Chlorophenyl) -2,6-Diphenylpyrimidine
OR96047-01	4-Bromo-2,6-diphenylpyrimidine