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Carbamic Acid Propyl Ester

CAT: 0572-TRC-C175785-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-C175785-25MGSize:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
627-12-3
Hazard Statement
Harmful if swallowed
Smiles
CCCOC(=O)N
Molecular Formula
C4 H9 N O2
Molecular Weight
103.12
InChI
InChI=1S/C4H9NO2/c1-2-3-7-4(5)6/h2-3H2,1H3,(H2,5,6)
Additionnal Information
IUPAC name: propyl carbamate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Propyl carbamate

N-Propyl carbamate is a carbamate ester.

CAS Number627-12-3
PubChem CID12306
IUPAC Namepropyl carbamate
Molecular FormulaC4H9NO2
Molecular Weight103.12
XLogP0.4
Topological Polar Surface Area52.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count7
Formal Charge0
Complexity62
SMILES
CCCOC(=O)N
InChI
InChI=1S/C4H9NO2/c1-2-3-7-4(5)6/h2-3H2,1H3,(H2,5,6)
InChIKey
YNTOKMNHRPSGFU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propyl carbamate
CAS: 627-12-3
CID: 12306
Formula: C4H9NO2
MW: 103.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight103.12
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass103.063328530
Monoisotopic Mass103.063328530
Topological Polar Surface Area52.3 Ų
Heavy Atom Count7
Formal Charge0
Complexity62.7
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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Alternative Products

CatalogName
sc-391615Carbamic acid propyl ester
WXB15757-01(3-Chlorosulfonyl-propyl) -carbamic acid benzyl ester
sc-287819A(2-Aminoethyl) propyl-carbamic acid tert-butyl ester
279969-01(2-Hydroxyethyl) propyl-carbamic acid tert-butyl ester
FQA43133[3- (4-Formylphenoxy) -propyl]-carbamic acid tert-butyl ester
sc-344890(3-Chloro-propyl) -methyl-carbamic acid tert-butyl ester
418309-01(2-Hydroxy-ethyl) -propyl-carbamic acid tert-butyl ester
BAA74677Carbamic acid isopropyl ester
230429-01(2-Hydroxyethyl) propyl-carbamic acid tert-butyl ester, > ≥96% (HPLC)
423661-01(3-Amino-1-methyl-propyl) -carbamic acid tert-butyl ester

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