AG00D6HM

Name: Methyl 3-(benzylamino)butanoate
Brand: Angene Chemical
SKU: AG00D6HM

40871-00-9 | Methyl 3-(benzylamino)butanoate

AG00D6HM

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CAS Number	40871-00-9
Catalog Number	AG00D6HM(AGN-PC-00MHR5)
Chemical Name	Methyl 3-(benzylamino)butanoate
IUPAC Name	methyl 3-(benzylamino)butanoate
InChI	InChI=1S/C12H17NO2/c1-10(8-12(14)15-2)13-9-11-6-4-3-5-7-11/h3-7,10,13H,8-9H2,1-2H3
InChI Key	BNNDKMWWUARZGQ-UHFFFAOYSA-N
MDL Number	MFCD12131728
Molecular Formula	C12H17NO2
Molecular Weight	207.2689
SMILES	CC(NCC1=CC=CC=C1)CC(OC)=O
Synonyms	METHYL 3-(BENZYLAMINO)BUTANOATE, 40871-00-9, 3-benzylamino-butyric acid methyl ester, 112979-62-1, ACMC-20mhb7, Butanoic acid, 3-[(phenylmethyl)amino]-, methyl ester, (S)-, SCHEMBL891954, CTK1D4221, BNNDKMWWUARZGQ-UHFFFAOYSA-N, KS-00001L2S, MFCD12131728, methyl (-)-3-(benzylamino)butanoate, AS06675, 3-(Benzylamino)butyric acid methyl ester, AS-36852, X-2399, Butanoic acid, 3-[(phenylmethyl)amino]-, methyl ester, F1911-3077, methyl (RS)-3-(N-benzylamino)butyrate, (1-(5-CARBOXYPENTYL)-3,3-DIMETHYL-3H-INDOL-1-IUM-2-YL)METHANIDE HYDROBROMIDE, 507444-65-7,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.126g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	207.273g/mol
Monoisotopic Mass	207.126g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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