N'-(mesitylmethylene)-3-methyl-2-thiophenecarbohydrazide

Update Time: 2025-04-25 16:57:07

	Common Name	N'-(mesitylmethylene)-3-methyl-2-thiophenecarbohydrazide	English Name	N'-(mesitylmethylene)-3-methyl-2-thiophenecarbohydrazide
	CAS NO.	N/A	Molecular Weight	286.4
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₆H₁₈N₂OS	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A
	Symbol	N/A	Signal Word	N/A

Properties

English Name	N'-(mesitylmethylene)-3-methyl-2-thiophenecarbohydrazide

Molecular Formula	C16H18N2OS
Molecular Weight	286.4
Exact Mass	286.11398438
LogP	4.30
Standard SMILES	Cc1cc(C)c(C=NNC(=O)c2sccc2C)c(C)c1
Canonical SMILES	CC1=C(SC=C1)C(=O)NN=CC2=C(C=C(C=C2C)C)C
Isomeric SMILES	CC1=C(SC=C1)C(=O)N/N=C/C2=C(C=C(C=C2C)C)C
Standard InChI Identifier	InChI=1S/C16H18N2OS/c1-10-7-12(3)14(13(4)8-10)9-17-18-16(19)15-11(2)5-6-20-15/h5-9H,1-4H3,(H,18,19)/b17-9+
Standard InChI Key	YAURVMOKIVEHQS-RQZCQDPDSA-N
Compound Complexity	360.00
computational chemistry	Hydrogen Bond Acceptor Count：3 Hydrogen Bond Donor Count：1 Rotatable Bond Count：3 Heavy Atom Count：20 Total Chiral Atom Count：0 Defined Chiral Atom Count：0 Undefined Chiral Atom Count：0 Total Chiral Bond Count：1 Defined Chiral Bond Count：1 Undefined Chiral Bond Count：0 Isotope Atom Count：0 Covalent Unit Count：1 Tautomer Count：4 Monoisotopic Mass：286.11398438