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Fast Red Violet LB salt

CAT: 0063-10141486-5gSize: 5 gDry Ice: NoHazardous: No
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CAT#:0063-10141486-5gSize:5 g
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CAS Number
32348-81-5
Molecular Formula
C14H11Cl2N3O
Molecular Weight
376.31

Chemical Information

fast red violet lb salt
CAS Number32348-81-5
PubChem CID16219357
IUPAC Name4-benzamido-5-chloro-2-methylbenzenediazonium chloride
Molecular FormulaC14H11Cl2N3O
Molecular Weight308.2
Topological Polar Surface Area57.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity372
SMILES
CC1=CC(=C(C=C1[N+]#N)Cl)NC(=O)C2=CC=CC=C2.[Cl-]
InChI
InChI=1S/C14H10ClN3O.ClH/c1-9-7-13(11(15)8-12(9)18-16)17-14(19)10-5-3-2-4-6-10;/h2-8H,1H3;1H
InChIKey
SARKXLKWFKNUMR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of fast red violet lb salt
CAS: 32348-81-5
CID: 16219357
Formula: C14H11Cl2N3O
MW: 308.2
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight308.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass307.0279174
Monoisotopic Mass307.0279174
Topological Polar Surface Area57.3 Ų
Heavy Atom Count20
Formal Charge0
Complexity372
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes