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2H-1,3,2-Oxazaphosphorine, tetrahydro-2-(bis(2-chloroethyl)amino)-5,5,6-trimethyl-, 2-oxide

HCID 3060465
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Basic information

CAS
78149-79-8
Standard SMILES
CC1OP(=O)(N(CCCl)CCCl)NCC1(C)C
InChIKey
FHNZBIVSSDZMLF-UHFFFAOYSA-N
Molecular formula
C10H21Cl2N2O2P
Average molar mass
303.16 g/mol
Monoisotopic mass
302.0717703

Names & identifiers

Preferred name
2H-1,3,2-Oxazaphosphorine, tetrahydro-2-(bis(2-chloroethyl)amino)-5,5,6-trimethyl-, 2-oxide
IUPAC
N,N-bis(2-chloroethyl)-5,5,6-trimethyl-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine

Names & synonyms

B 693Tetrahydro-2-(bis(2-chloroethyl)amino)-5,5,6-trimethyl-2H-1,3,2-oxazaphosphorine 2-oxide78149-79-82H-1,3,2-Oxazaphosphorine, tetrahydro-2-(bis(2-chloroethyl)amino)-5,5,6-trimethyl-, 2-oxideRefChem:267714DTXSID009993892-[Bis(2-chloroethyl)amino]-5,5,6-trimethyl-1,3,2lambda~5~-oxazaphosphinan-2-one

Database identifiers

CAS
78149-79-8
PubChem CID
3060465
DTXSID
DTXSID00999389
Nikkaji
J78.569E

Properties

Computed structural properties

XLogP
2
Topological polar surface area
41.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
17
Formal charge
0
Complexity
296

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