AG003M5I

40126-55-4 | 5-(4-Chlorobutyl)imidazolidine-2,4-dione

AG003M5I

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CAS Number	40126-55-4
Catalog Number	AG003M5I(AGN-PC-0RM1CD)
Chemical Name	5-(4-Chlorobutyl)imidazolidine-2,4-dione
IUPAC Name	5-(4-chlorobutyl)imidazolidine-2,4-dione
InChI	InChI=1S/C7H11ClN2O2/c8-4-2-1-3-5-6(11)10-7(12)9-5/h5H,1-4H2,(H2,9,10,11,12)
InChI Key	ZKHLVOULDIXSCC-UHFFFAOYSA-N
MDL Number	MFCD00059722
Molecular Formula	C7H11ClN2O2
Molecular Weight	190.6274
NSC Number	23787
SMILES	O=C(N1)NC(CCCCCl)C1=O
Synonyms	5-(4-Chlorobutyl)hydantoin, 40126-55-4, 5-(4-chlorobutyl)imidazolidine-2,4-dione, 5-(4-chlorobutyl)-1,3-diazolidine-2,4-dione, NSC23787, ACMC-209jax, AC1Q6GJF, AC1L5I4J, SCHEMBL8182786, CTK4I2487, DTXSID20282003, ZKHLVOULDIXSCC-UHFFFAOYSA-N, KS-000012IY, 2602AE, ANW-29287, MFCD00059722, NSC-23787, SBB055867, AKOS025116874, MCULE-9768843961, ACM40126554, CC-20715, DB-049534, TC-118032, 2,4-Imidazolidinedione,5-(4-chlorobutyl)-, FT-0639609, ST50950033, 5-(4-Chlorobutyl)-2,4-imidazolidinedione #, C-08161, InChI=1/C7H11ClN2O2/c8-4-2-1-3-5-6(11)10-7(12)9-5/h5H,1-4H2,(H2,9,10,11,12, C7H11ClN2O2, AR-1G5222, c0902, CID229807, 5301-29-1,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.051g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	190.627g/mol
Monoisotopic Mass	190.051g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	58.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number