CAS
85-95-0 Purity
96%
85-95-0 Purity
96%
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1H-Benzimidazole-1-ethanamine,2-[(4-ethoxyphenyl)methyl]-N,N-diethyl-5-isothiocyanato-
CAS
85951-65-1
Catalog Number
ACM85951651
Category
Other Products
Molecular Weight
408.57
Molecular Formula
C23H28N4OS
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Specification
Synonyms
ETONITAZENYL ISOTHIOCYANATE; BIT; Etonitazenyl isothicyanate; Bit alkylating agent; Tocris-0516;
IUPAC Name
2-[2-[(4-ethoxyphenyl)methyl]-5-isothiocyanatobenzimidazol-1-yl]-N,N-diethylethanamine
Canonical SMILES
CCN(CC)CCN1C2=C(C=C(C=C2)N=C=S)N=C1CC3=CC=C(C=C3)OCC
InChI Key
QIIKEXXYYPDZHL-UHFFFAOYSA-N
Boiling Point
595ºC at 760 mmHg
Melting Point
64-66ºC
Flash Point
313.6ºC
Density
1.13g/cm³
Exact Mass
408.19800
H-Bond Acceptor
4
H-Bond Donor
0
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