Chemical Name: Oxiranemethanamine, N-[4-(oxiranylmethoxy)phenyl]-N-(oxiranylmethyl)-
IUPAC Name: 4-(oxiran-2-ylmethoxy)-N,N-bis(oxiran-2-ylmethyl)aniline
CAS RN: 5026-74-4
Description: single chemical compound
STRUCTURE Formula: C15H19NO4
Molecular Weight: 277.3157
SMILES: N(CC3CO3)(CC4CO4)C1=CC=C(OCC2CO2)C=C1
Note:
Chemical Name: Ethanaminium, N,N,N-trimethyl-2-[(2-methyl-1-oxo-2-propenyl)oxy]-, chloride
IUPAC Name: 2-(methacryloyloxy)-N,N,N-trimethylethanaminium chloride
CAS RN: 5039-78-1
Description: single chemical compound
STRUCTURE Formula: C9H18ClNO2
Molecular Weight: 207.6977
SMILES: O=C(C(C)=C)OCC[N+](C)(C)C.[Cl-]
Note: ammonium, parent [33611-56-2]
Chemical Name: Glycine, N,N-bis(carboxymethyl)-, trisodium salt
IUPAC Name: trisodium 2,2',2''-nitrilotriacetate
CAS RN: 5064-31-3
Description: single chemical compound
STRUCTURE Formula: C6H6NNa3O6
Molecular Weight: 257.0842
SMILES: O=C(CN(CC([O-])=O)CC([O-])=O)[O-].[Na+].[Na+].[Na+]
Note: parent [139-13-9]
Chemical Name: Cyclohexane, 1,1'-methylenebis[4-isocyanato-
IUPAC Name: 1,1'-methylenebis(4-isocyanatocyclohexane)
CAS RN: 5124-30-1
Description: single chemical compound
STRUCTURE Formula: C15H22N2O2
Molecular Weight: 262.3474
SMILES: O=C=NC1CCC(CC2CCC(N=C=O)CC2)CC1
Note:
Chemical Name: 2-Propanol, 1-butoxy-
IUPAC Name: 1-butoxypropan-2-ol
CAS RN: 5131-66-8
Description: single chemical compound
STRUCTURE Formula: C7H16O2
Molecular Weight: 132.2007
SMILES: OC(C)COCCCC
Note:
Chemical Name: Benzenesulfonic acid, 5-chloro-2-[(2-hydroxy-1-naphthalenyl)azo]-4-methyl-, barium salt (2:1)
IUPAC Name: barium bis{5-chloro-2-[(E)-(2-hydroxynaphthalen-1-yl)diazenyl]-4-methylbenzenesulfonate}
CAS RN: 5160-02-1
Description: single chemical compound
STRUCTURE Formula: C34H24BaCl2N4O8S2
Molecular Weight: 888.9394
SMILES: ClC(C(C)=C2)=CC(S(=O)([O-])=O)=C2/N=N/C1=C3C(C=CC=C3)=CC=C1O.ClC(C(C)=C5)=CC(S(=O)([O-])=O)=C5/N=N/C4=C6C(C=CC=C6)=CC=C4O.[Ba+2]
Note: C.I. 15585:1, parent [15958-19-7]
Chemical Name: 1-Propanesulfonic acid, 2-methyl-2-[(1-oxo-2-propenyl)amino]-, monosodium salt
IUPAC Name: sodium 2-(acryloylamino)-2-methylpropane-1-sulfonate
CAS RN: 5165-97-9
Description: single chemical compound
STRUCTURE Formula: C7H12NNaO4S
Molecular Weight: 229.2293
SMILES: O=S(CC(NC(C=C)=O)(C)C)([O-])=O.[Na+]
Note:
Chemical Name: Methanethiol, sodium salt
IUPAC Name: sodium methanethiolate
CAS RN: 5188-07-8
Description: single chemical compound
STRUCTURE Formula: CH3NaS
Molecular Weight: 70.0893
SMILES: [S-]C.[Na+]
Note: parent [74-93-1]
Chemical Name: Benzene, 1-chloro-4-(trichloromethyl)-
IUPAC Name: 1-chloro-4-(trichloromethyl)benzene
CAS RN: 5216-25-1
Description: single chemical compound
STRUCTURE Formula: C7H4Cl4
Molecular Weight: 229.9187
SMILES: ClC1=CC=C(C(Cl)(Cl)Cl)C=C1
Note:
Chemical Name: 2-Naphthalenecarboxylic acid, 3-hydroxy-4-[(4-methyl-2-sulfophenyl)azo]-, calcium salt (1:1)
IUPAC Name: calcium 3-hydroxy-4-[(E)-(4-methyl-2-sulfonatophenyl)diazenyl]-2-naphthoate
CAS RN: 5281-04-9
Description: single chemical compound
STRUCTURE Formula: C18H12CaN2O6S
Molecular Weight: 424.4407
SMILES: O=C([O-])C2=CC1=C(C(/N=N/C3=C(S(=O)([O-])=O)C=C(C)C=C3)=C2O)C=CC=C1.[Ca+2]
Note: C.I. 15850:1
Chemical Name: 1-Octanesulfonic acid, sodium salt
IUPAC Name: sodium octane-1-sulfonate
CAS RN: 5324-84-5
Description: single chemical compound
STRUCTURE Formula: C8H17NaO3S
Molecular Weight: 216.2736
SMILES: O=S(CCCCCCCC)([O-])=O.[Na+]
Note: parent [3944-72-7]
Chemical Name: 1-Propanamine, 3-methoxy-
IUPAC Name: 3-methoxypropan-1-amine
CAS RN: 5332-73-0
Description: single chemical compound
STRUCTURE Formula: C4H11NO
Molecular Weight: 89.1362
SMILES: NCCCOC
Note:
Chemical Name: 2,6-Octadienal, 3,7-dimethyl-
IUPAC Name: (2E)-3,7-dimethylocta-2,6-dienal
CAS RN: 5392-40-5
Description: mixture or formulation
STRUCTURE Formula: C10H16O
Molecular Weight: 152.2334
SMILES: O=CC=C(CCC=C(C)C)C
Note: mixture of Z [106-26-3], E [141-27-5] isomers structure shown E, stereochem
Chemical Name: Boric acid (H3BO3), tris(1-methylethyl) ester
IUPAC Name: triisopropyl borate
CAS RN: 5419-55-6
Description: single chemical compound
STRUCTURE Formula: C9H21BO3
Molecular Weight: 188.0722
SMILES: CC(C)OB(OC(C)C)OC(C)C
Note:
Chemical Name: Acetic acid, mercapto-, monoammonium salt
IUPAC Name: ammonium mercaptoacetate
CAS RN: 5421-46-5
Description: single chemical compound
STRUCTURE Formula: C2H7NO2S
Molecular Weight: 109.1475
SMILES: O=C(CS)[O-].[NH4+]
Note: parent [68-11-1]
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