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CAT: 0127-BUP06132-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP06132-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2374313-54-7
Purity
=98%
Smiles
CCCCCCCCCCCCCCCCNNC(=O)c1cccs1

Chemical Information

2-Thiophenecarboxylic acid, 2-hexadecylhydrazide
CAS Number2374313-54-7
PubChem CID139035087
IUPAC NameN'-hexadecylthiophene-2-carbohydrazide
Molecular FormulaC21H38N2OS
Molecular Weight366.6
XLogP8.7
Topological Polar Surface Area69.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count17
Heavy Atom Count25
Formal Charge0
Complexity312
SMILES
CCCCCCCCCCCCCCCCNNC(=O)C1=CC=CS1
InChI
InChI=1S/C21H38N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-22-23-21(24)20-17-16-19-25-20/h16-17,19,22H,2-15,18H2,1H3,(H,23,24)
InChIKey
HSHXDCVZWHOWCS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Thiophenecarboxylic acid, 2-hexadecylhydrazide
CAS: 2374313-54-7
CID: 139035087
Formula: C21H38N2OS
MW: 366.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight366.6
XLogP38.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count17
Exact Mass366.27048501
Monoisotopic Mass366.27048501
Topological Polar Surface Area69.4 Ų
Heavy Atom Count25
Formal Charge0
Complexity312
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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