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Methyl Carbamate

CAT: 0572-TRC-M294908-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-M294908-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
598-55-0
Synonyms
Methylurethane; Urethylane; Methyl Ester Carbamic Acid
Hazard Statement
Suspected of causing cancer.
Smiles
COC(=O)N
Molecular Formula
C2H5NO2
Molecular Weight
75.07
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Methyl Carbamate

Methyl Carbamate can cause cancer according to The National Toxicology Program.

CAS Number598-55-0
PubChem CID11722
IUPAC Namemethyl carbamate
Molecular FormulaC2H5NO2
Molecular Weight75.07
XLogP-0.7
Topological Polar Surface Area52.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count5
Formal Charge0
Complexity42
SMILES
COC(=O)N
InChI
InChI=1S/C2H5NO2/c1-5-2(3)4/h1H3,(H2,3,4)
InChIKey
GTCAXTIRRLKXRU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl Carbamate
CAS: 598-55-0
CID: 11722
Formula: C2H5NO2
MW: 75.07
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight75.07
XLogP3-0.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass75.032028402
Monoisotopic Mass75.032028402
Topological Polar Surface Area52.3 Ų
Heavy Atom Count5
Formal Charge0
Complexity42.9
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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