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Para Red

CAT: 0926-FP52643-02Size: 500 gDry Ice: NoHazardous: No
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CAT#:0926-FP52643-02Size:500 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
6410-10-2
Synonyms
Pigment Red 1; CI 127;1- (4-Nitrophenylazo) -2-naphthol
MDL Number
MFCD00003908
Smiles
C1=CC=C2C (=C1) C=CC (=C2N=NC3=CC=C (C=C3) [N+] (=O) [O-]) O
Molecular Formula
C16H11N3O3
Molecular Weight
293.28 g/mol
Controlled
No

Chemical Information

Para Red

See also: Pigment Red 1 (annotation moved to).

CAS Number6410-10-2
PubChem CID22917
IUPAC Name1-[(4-nitrophenyl)diazenyl]naphthalen-2-ol
Molecular FormulaC16H11N3O3
Molecular Weight293.28
XLogP4
Topological Polar Surface Area90.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity415
SMILES
C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC=C(C=C3)[N+](=O)[O-])O
InChI
InChI=1S/C16H11N3O3/c20-15-10-5-11-3-1-2-4-14(11)16(15)18-17-12-6-8-13(9-7-12)19(21)22/h1-10,20H
InChIKey
WOTPFVNWMLFMFW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Para Red
CAS: 6410-10-2
CID: 22917
Formula: C16H11N3O3
MW: 293.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight293.28
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass293.08004122
Monoisotopic Mass293.08004122
Topological Polar Surface Area90.8 Ų
Heavy Atom Count22
Formal Charge0
Complexity415
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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