AG00G2E9

76272-35-0 | 8-Benzyl-3α-amino-1αH,5αH-nortropane

AG00G2E9

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CAS Number	76272-35-0
Catalog Number	AG00G2E9(AGN-PC-0U9EUP)
Chemical Name	8-Benzyl-3α-amino-1αH,5αH-nortropane
EC Number	616-315-7
IUPAC Name	(1R,5S)-8-benzyl-8-azabicyclo[3.2.1]octan-3-amine
InChI	InChI=1S/C14H20N2/c15-12-8-13-6-7-14(9-12)16(13)10-11-4-2-1-3-5-11/h1-5,12-14H,6-10,15H2/t12?,13-,14+
InChI Key	TZWXPIKAEAYGPF-AGUYFDCRSA-N
MDL Number	MFCD08460051
Molecular Formula	C14H20N2
Molecular Weight	216.3220
SMILES	N[C@@H]3C[C@@]([H])(CC[C@@](C3)2[H])N2CC1=CC=CC=C1
Synonyms	76272-35-0, 8-Benzyl-3a-amino-1aH,5aH-nortropane, 76272-36-1, endo-8-Benzyl-8-azabicyclo[3.2.1]octan-3-amine, (1R,5S)-endo-8-Benzyl-8-azabicyclo[3.2.1]octan-3-amine, (1R,5S)-8-benzyl-8-azabicyclo[3.2.1]octan-3-amine, EXO-3-AMINO-8-BENZYL-8-AZABICYCLO[3.2.1]OCTANE, 8-Benzyl-8-azabicyclo[3.2.1]octan-3-endo-amine, 8-Benzyl-8-azabicyclo[3.2.1]octane-3-endo-amine, 3-AMINO-8-BENZYL-8-AZABICYCLO[3.2.1]OCTANE (3-EXO)-, PubChem19312, 8-Benzyl-8-azabicyclo[3.2.1]octane-3-exo-amine, 8-Azabicyclo[3.2.1]octan-3-amine,8-(phenylmethyl)-,endo-, SCHEMBL168286, SCHEMBL15021133, MFCD08460051, ZINC21302905, 8-Benzyl-3-amino-1H,5H-nortropane, AKOS015920257, AKOS017344555, ZINC100013265, ZINC100013521, DS-1433, PB23672, AJ-78408, AK-24003, AS-50630, BR-24003, AB0009998, ST2407846, ST2413090, S-7648, 272A361, 272B350, 8-Benzyl-3alpha-amino-1alphaH,5alphaH-nortropane, (1R,5S)-endo-8-Benzyl-8-azabicyclo-[3.2.1]octan-3-amine, 8-Azabicyclo[3.2.1]octan-3-amine;8-(phenylmethyl)-endo-3-AMINO-8-BENZYL-8-AZABICYCLO[3.2.1]OCTANE (3-ENDO)-8-BENZYL-3A-AMINO-1AH5AH-NORTROPANE, 8-Benzyl-8-azabicyclo[3.2.1]octan-3-exo-amine, C14H20N2, exo-8-Benzyl-8-azabicyclo[3.2.1]octan-3-amine, CID11031267, 8-benzyl-8-azabicyclo[3.2.1]octan-3-amine, 3-AMINO-8-BENZYL-8-AZABICYCLO[3.2.1]OCTANE, 3-AMINO-8-BENZYL-8-AZABICYCLO[3.2.1]OCTANE -, 3-amino-8-benzyl-8-azabicyclo[3.2.1]octane,(3-endo)-,

Complexity	221
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	216.163g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.328g/mol
Monoisotopic Mass	216.163g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number