2-Mercaptobenzimidazole

CAT: 0024-sc-230450Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-230450Size:5 g

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CAS Number

583-39-1

Chemical Information

2-Mercaptobenzimidazole

1H-benzo[d]imidazole-2-thiol is a member of benzimidazoles.

CAS Number	583-39-1
PubChem CID	707035
IUPAC Name	1,3-dihydrobenzimidazole-2-thione
Molecular Formula	C7H6N2S
Molecular Weight	150.20
XLogP	1.7
Topological Polar Surface Area	56.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	142

SMILES

C1=CC=C2C(=C1)NC(=S)N2

InChI

InChI=1S/C7H6N2S/c10-7-8-5-3-1-2-4-6(5)9-7/h1-4H,(H2,8,9,10)

InChIKey

YHMYGUUIMTVXNW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 583-39-1

CID: 707035

Formula: C7H6N2S

MW: 150.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	150.20
XLogP3	1.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	150.02516937
Monoisotopic Mass	150.02516937
Topological Polar Surface Area	56.2 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	142
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-492226	2-Mercaptobenzimidazol zinc salt
sc-209283	2,2,2-Trifluoroethyl 2,5-Bis (2,2,2-trifluoroethoxy) benzoate
sc-209282	2,2,2-Trifluoroethyl 2-Hydroxy-5- (2,2,2-trifluoroethoxy) benzoate
sc-343301A	2,2,2-trifluoroethyl 2-fluorophenylcarbamate
sc-320473	2- (2,2,2-trifluoroethoxy) benzaldehyde
sc-343303A	2,2,2-trifluoroethyl 2-methoxyphenylcarbamate
sc-475858	2- (2,2,2-Trifluoroethoxy) phenol
sc-356285	2- (2,2,2-Trifluoroethoxy) nitrobenzene
sc-474673	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]-ethanol
sc-506736	2'-Amino-2,2,2-trifluoroacetophenone

Catalog	Name
TRC-M225190-5G	2-Mercaptobenzimidazole
OR912702-01	Methyl-2-mercaptobenzimidazole
TYD-00323-01	5-Difluoromethoxy-2-mercaptobenzimidazole
TRC-H945720-100MG	6-Hydroxy-2-mercaptobenzimidazole
RG-A262503-01	5-Amino-2-Mercaptobenzimidazole
MBS6099196-01	5-Benzyloxy-2-mercaptobenzimidazole
A36600	4-Aza-2-mercaptobenzimidazole
01649 01000	2-Mercaptobenzimidazole 98% For Synthesis
FD05695-01	5- (Difluoromethoxy) -2-mercaptobenzimidazole
284981-01	5-Nitro-2-mercaptobenzimidazole