4-(2-chloroacetyl)-3,3-dimethylpiperazin-2-one

4-(2-chloroacetyl)-3,3-dimethylpiperazin-2-one

CAS: 626223-67-4

Formula: C8H13ClN2O2

SMILES: CC1(C)N(CCNC1=O)C(=O)CCl

IUPAC: 4-(2-chloroacetyl)-3,3-dimethylpiperazin-2-one

InChI: InChI=1S/C8H13ClN2O2/c1-8(2)7(13)10-3-4-11(8)6(12)5-9/h3-5H2,1-2H3,(H,10,13)

Composition: C (46.95%), H (6.40%), Cl (17.32%), N (13.69%), O (15.64%)

Molar Mass: 204.65

Atom Count: 26

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	204.0665554
Formal Charge	0
FSP3	0.75
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	QPDIPPJPRSUWBL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.05
Topological Polar Surface Area	49.41
Polarizability	19.1
Ring Count	1
Rotatable Bond Count	1

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