AG019OJ6

Name: 4-{[(adamantan-1-yl)formamido]methyl}benzoic acid
Brand: Angene Chemical
SKU: AG019OJ6

848316-29-0 | 4-{[(adamantan-1-yl)formamido]methyl}benzoic acid

AG019OJ6

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CAS Number	848316-29-0
Catalog Number	AG019OJ6
Chemical Name	4-{[(adamantan-1-yl)formamido]methyl}benzoic acid
IUPAC Name	4-[(adamantane-1-carbonylamino)methyl]benzoic acid
InChI	InChI=1S/C19H23NO3/c21-17(22)16-3-1-12(2-4-16)11-20-18(23)19-8-13-5-14(9-19)7-15(6-13)10-19/h1-4,13-15H,5-11H2,(H,20,23)(H,21,22)
InChI Key	MWRRKIOCVXHVSL-UHFFFAOYSA-N
MDL Number	MFCD07330843
Molecular Formula	C19H23NO3
Molecular Weight	313.3908
SMILES	OC(C1=CC=C(CNC(C23CC4CC(C2)CC(C4)C3)=O)C=C1)=O
Synonyms	4-[(adamantan-1-ylformamido)methyl]benzoic acid, 4-{[(1-adamantylcarbonyl)amino]methyl}benzoic acid, 848316-29-0, 4-([(1-ADAMANTYLCARBONYL)AMINO]METHYL)BENZOIC ACID, AC1NLR8Z, 4-[(adamantane-1-carbonylamino)methyl]benzoic Acid, MLS001179723, AC1Q739P, CHEMBL1480484, CTK7F5404, HMS2896L19, ZINC4207376, AKOS000117779, NE31703, SMR000595101, EN300-14143, AB00738761-01, SR-01000073731, SR-01000073731-1, CID4962855,

Complexity	452
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	313.168g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	313.397g/mol
Monoisotopic Mass	313.168g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited