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Hexamethylphosphoramide

CAT: 1299-RG-A262287-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-A262287-03Size:50 mg
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CAS Number
680-31-9
Synonyms
Hempa; ENT 50,882; Hexamethylphosphoramide
Molecular Formula
C6H18N3OP
Molecular Weight
179.2
Product Name Synonym
Hempa; ENT 50,882; Hexamethylphosphoramide

Chemical Information

Hexamethylphosphoramide

Hexamethylphosphoramide can cause cancer according to an independent committee of scientific and health experts. It can cause male reproductive toxicity according to The Environmental Protection Agency (EPA).

CAS Number680-31-9
PubChem CID12679
IUPAC NameN-[bis(dimethylamino)phosphoryl]-N-methylmethanamine
Molecular FormulaC6H18N3OP
Molecular Weight179.20
XLogP0.3
Topological Polar Surface Area26.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count11
Formal Charge0
Complexity139
SMILES
CN(C)P(=O)(N(C)C)N(C)C
InChI
InChI=1S/C6H18N3OP/c1-7(2)11(10,8(3)4)9(5)6/h1-6H3
InChIKey
GNOIPBMMFNIUFM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hexamethylphosphoramide
CAS: 680-31-9
CID: 12679
Formula: C6H18N3OP
MW: 179.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight179.20
XLogP30.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass179.11874920
Monoisotopic Mass179.11874920
Topological Polar Surface Area26.8 Ų
Heavy Atom Count11
Formal Charge0
Complexity139
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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