AG001NWF

Name: Benzoic acid, 3-[(dimethylamino)methyl]-
Brand: Angene Chemical
SKU: AG001NWF

155412-73-0 | Benzoic acid, 3-[(dimethylamino)methyl]-

AG001NWF

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CAS Number	155412-73-0
Catalog Number	AG001NWF(AGN-PC-0WB6XO)
Chemical Name	Benzoic acid, 3-[(dimethylamino)methyl]-
IUPAC Name	3-[(dimethylamino)methyl]benzoic acid
InChI	InChI=1S/C10H13NO2/c1-11(2)7-8-4-3-5-9(6-8)10(12)13/h3-6H,7H2,1-2H3,(H,12,13)
InChI Key	JOHOBHQNCZAHOU-UHFFFAOYSA-N
MDL Number	MFCD07801107
Molecular Formula	C10H13NO2
Molecular Weight	179.2157
SMILES	CN(C)CC1=CC=CC(=C1)C(O)=O
Synonyms	155412-73-0, 3-((dimethylamino)methyl)benzoic acid, 3-[(dimethylamino)methyl]benzoic acid, 3-Dimethylaminomethyl-benzoic acid, 3-(dimethylaminomethyl)benzoic acid, 3-Dimethylaminomethylbenzoicacid, akos bb-9404, Benzoic acid, 3-[(dimethylamino)methyl]-, AC1Q3WNM, timtec-bb sbb010639, chembrdg-bb 4014707, AC1O5H0S, ukrorgsyn-bb bbv-182410, SCHEMBL168738, 3-(dimethylammoniomethyl)benzoate, CTK4C8692, DTXSID20424360, HMS1697G03, 3-(dimethylazaniumylmethyl)benzoate, ALBB-015106, ZINC6676755, ANW-66918, SBB010639, AKOS000100781, MCULE-6996826152, RTR-006499, AJ-56606, BAS 09902925, AB0135244, DB-064087, TR-044923, BB 0216459, FT-0647993, ST50321122, EN300-50358, A18240, Y-3269, J-009195, 3-[(dimethylamino)methyl]benzoic acid(saltdata: hcl), benzoic acid, 3-[(dimethylamino)methyl]-, hydrochloride, CID6484070, 3-[(dimethylamino)methyl]benzoic acid hydrochloride,

Complexity	180
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.095g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	179.219g/mol
Monoisotopic Mass	179.095g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

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