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N,N-bis(2-chloroethyl)-2-oxo-1,3,2lambda5-benzodioxaphosphol-2-amine

HCID 320152
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Basic information

CAS
2091-02-3
Standard SMILES
O=P1(N(CCCl)CCCl)Oc2ccccc2O1
InChIKey
CQSQCEIFDWENFW-UHFFFAOYSA-N
Molecular formula
C10H12Cl2NO3P
Average molar mass
296.08 g/mol
Monoisotopic mass
294.9931856

Names & identifiers

Preferred name
N,N-bis(2-chloroethyl)-2-oxo-1,3,2lambda5-benzodioxaphosphol-2-amine
IUPAC
N,N-bis(2-chloroethyl)-2-oxo-1,3,2λ5-benzodioxaphosphol-2-amine

Names & synonyms

NSC2663432091-02-3DTXSID90313136NSC-2663432-[Bis(2-chloroethyl)amino]-2H-1,3,2lambda~5~-benzodioxaphosphol-2-one

Database identifiers

CAS
2091-02-3
PubChem CID
320152
DTXSID
DTXSID90313136

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
17
Formal charge
0
Complexity
281

Related reactions

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Compound notes

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