fluoro N,N-bis(sulfanyl)carbamate

CH2FNO2S2 — CID 57174157

IUPACfluoro N,N-bis(sulfanyl)carbamate
SMILESO=C(OF)N(S)S
InChIInChI=1S/CH2FNO2S2/c2-5-1(4)3(6)7/h6-7H
InChIKeyYPHXUBPNVSYOFQ-UHFFFAOYSA-N
MW143.16 g/mol
LogP1.00
Rot. Bonds

About fluoro N,N-bis(sulfanyl)carbamate

fluoro N,N-bis(sulfanyl)carbamate (PubChem CID 57174157) has the molecular formula CH2FNO2S2 and a molecular weight of 143.16 g/mol. Its IUPAC name is fluoro N,N-bis(sulfanyl)carbamate.

Molecular Properties

Compound Namefluoro N,N-bis(sulfanyl)carbamate
PubChem CID57174157
Molecular FormulaCH2FNO2S2
Molecular Weight143.16 g/mol
Exact Mass142.95
IUPAC Namefluoro N,N-bis(sulfanyl)carbamate
SMILESO=C(OF)N(S)S
InChIInChI=1S/CH2FNO2S2/c2-5-1(4)3(6)7/h6-7H
InChIKeyYPHXUBPNVSYOFQ-UHFFFAOYSA-N
XLogP1.00
TPSA29.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.16
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

bis(sulfanyl)carbamoperoxoic acid
CID 174318284
2-aminoethyl N,N-bis(sulfanyl)carbamate
CID 87837441
2-hydroxyprop-2-enyl N,N-bis(sulfanyl)carbamate
CID 87690036
iron;prop-2-enyl N,N-bis(sulfanyl)carbamate
CID 87288667
3-[bis(sulfanyl)carbamoyloxy]propanoic acid
CID 57010225
bis(sulfanyl)carbamic acid;ethenyl N,N-bis(sulfanyl)carbamate;zinc
CID 174418079
2-chloroprop-2-enyl N,N-bis(sulfanyl)carbamate
CID 174397624
2,3,3-trichloroprop-2-enyl N,N-bis(sulfanyl)carbamate
CID 57315932
fluoro N-benzyl-N-methylcarbamate
CID 144758254
bis(sulfanyl)carbamic acid;zirconium
CID 88817474
2-cyanoethenyl N,N-bis(sulfanyl)carbamate
CID 90897231
hexyl N,N-bis(sulfanyl)carbamate
CID 57100182

Frequently Asked Questions

What is the IUPAC name of fluoro N,N-bis(sulfanyl)carbamate?
The IUPAC name of fluoro N,N-bis(sulfanyl)carbamate (CID 57174157) is fluoro N,N-bis(sulfanyl)carbamate.
What is the SMILES notation for fluoro N,N-bis(sulfanyl)carbamate?
The canonical SMILES for fluoro N,N-bis(sulfanyl)carbamate is O=C(OF)N(S)S.
What is the InChIKey of fluoro N,N-bis(sulfanyl)carbamate?
The InChIKey is YPHXUBPNVSYOFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2FNO2S2/c2-5-1(4)3(6)7/h6-7H.
What are the key properties of fluoro N,N-bis(sulfanyl)carbamate?
fluoro N,N-bis(sulfanyl)carbamate has a molecular weight of 143.16 g/mol, XLogP of 1.00, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro N,N-bis(sulfanyl)carbamate is sourced from PubChem (CID 57174157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).