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87988-48-5 | Phosphonic acid, [3-ethyl-2-(1-methylethyl)-1-diaziridinyl]-, diethyl ester
CAS No: 87988-48-5 Catalog No: AG004OTX MDL No:
Product Description
Catalog Number:
AG004OTX
Chemical Name:
Phosphonic acid, [3-ethyl-2-(1-methylethyl)-1-diaziridinyl]-, diethyl ester
CAS Number:
87988-48-5
Molecular Formula:
C10H23N2O3P
Molecular Weight:
250.2750
IUPAC Name:
1-diethoxyphosphoryl-3-ethyl-2-propan-2-yldiaziridine
InChI:
InChI=1S/C10H23N2O3P/c1-6-10-11(9(4)5)12(10)16(13,14-7-2)15-8-3/h9-10H,6-8H2,1-5H3
InChI Key:
IDKMAVLMLFHTIL-UHFFFAOYSA-N
SMILES:
CCOP(=O)(N1N(C1CC)C(C)C)OCC
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.145g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.279g/mol
Monoisotopic Mass:
250.145g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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