NSC 102533 50mg

CAT: 0628-A22680-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A22680-50Size:50 mg

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

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CAS Number

1150-59-0

Chemical Information

2-Hydroxy-3-phenyl-1,4-naphthoquinone

CAS Number	1150-59-0
PubChem CID	265893
IUPAC Name	4-hydroxy-3-phenylnaphthalene-1,2-dione
Molecular Formula	C16H10O3
Molecular Weight	250.25
XLogP	2.5
Topological Polar Surface Area	54.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	19
Formal Charge	0
Complexity	429

SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C16H10O3/c17-14-11-8-4-5-9-12(11)15(18)16(19)13(14)10-6-2-1-3-7-10/h1-9,17H

InChIKey

HCKUADBGJIXWTR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1150-59-0

CID: 265893

Formula: C16H10O3

MW: 250.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	250.25
XLogP3	2.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	250.062994177
Monoisotopic Mass	250.062994177
Topological Polar Surface Area	54.4 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	429
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

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