hydroxy-oxo-[[N-[(2-oxoindol-3-yl)amino]carbamimidoyl]amino]azanium 5347-87-5 CAS NO.5347-87-5

Min.Order: 1 Gram
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Product Details

Keywords

hydroxy-oxo-[[N-[(2-oxoindol-3-yl)amino]carbamimidoyl]amino]azanium
5347-87-5
C16H17NO

Quick Details

ProName: hydroxy-oxo-[[N-[(2-oxoindol-3-yl)amin...
CasNo: 5347-87-5
Molecular Formula: C16H17NO
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: As client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 10 Kilogram/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Gram
Heavy metal: N/A
Grade: Industrial Grade

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Details

Identification and Related Records
【Name】
N-(2,5-dimethylphenyl)-4-methylbenzamide
【CAS Registry number】
5347-87-5
【Synonyms】
benzamide, N-(2,5-dimethylphenyl)-4-methyl-
【Molecular Formula】
C16H17NO (Products with the same molecular formula)
【Molecular Weight】
239.3123
【Inchi】
InChI=1/C16H17NO/c1-11-5-8-14(9-6-11)16(18)17-15-10-12(2)4-7-13(15)3/h4-10H,1-3H3,(H,17,18)
【Canonical SMILES】
CC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C)C
【MOL File】
5347-87-5.mol
Chemical and Physical Properties
【Density】
1.102g/cm3
【Boiling Point】
305.6°C at 760 mmHg
【Refractive Index】
1.61
【Flash Point】
184°C
【Computed Properties】
Molecular Weight:239.31228 [g/mol]
Molecular Formula:C16H17NO
XLogP3:3.5
H-Bond Donor:1
H-Bond Acceptor:1
Rotatable Bond Count:2
Tautomer Count:5
Exact Mass:239.131014
MonoIsotopic Mass:239.131014
Topological Polar Surface Area:29.1
Heavy Atom Count:18
Formal Charge:0
Complexity:281
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Ring Count:2
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:4Identification and Related Records
【Name】
N-(2,5-dimethylphenyl)-4-methylbenzamide
【CAS Registry number】
5347-87-5
【Synonyms】
benzamide, N-(2,5-dimethylphenyl)-4-methyl-
【Molecular Formula】
C16H17NO (Products with the same molecular formula)
【Molecular Weight】
239.3123
【Inchi】
InChI=1/C16H17NO/c1-11-5-8-14(9-6-11)16(18)17-15-10-12(2)4-7-13(15)3/h4-10H,1-3H3,(H,17,18)
【Canonical SMILES】
CC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C)C
【MOL File】
5347-87-5.mol
Chemical and Physical Properties
【Density】
1.102g/cm3
【Boiling Point】
305.6°C at 760 mmHg
【Refractive Index】
1.61
【Flash Point】
184°C
【Computed Properties】
Molecular Weight:239.31228 [g/mol]
Molecular Formula:C16H17NO
XLogP3:3.5
H-Bond Donor:1
H-Bond Acceptor:1
Rotatable Bond Count:2
Tautomer Count:5
Exact Mass:239.131014
MonoIsotopic Mass:239.131014
Topological Polar Surface Area:29.1
Heavy Atom Count:18
Formal Charge:0
Complexity:281
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Ring Count:2
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:4

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