AG0067XS

98569-12-1 | 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic Acid

AG0067XS

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CAS Number	98569-12-1
Catalog Number	AG0067XS(AGN-PC-0K2UIF)
Chemical Name	2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic Acid
IUPAC Name	2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-dihydro-1H-naphthalene-2-carboxylic acid
InChI	InChI=1S/C16H21NO4/c1-15(2,3)21-14(20)17-16(13(18)19)9-8-11-6-4-5-7-12(11)10-16/h4-7H,8-10H2,1-3H3,(H,17,20)(H,18,19)
InChI Key	DSDQZWPRZHNCIX-UHFFFAOYSA-N
MDL Number	MFCD00800586
Molecular Formula	C16H21NO4
Molecular Weight	291.3422
SMILES	O=C(C1(NC(OC(C)(C)C)=O)CC2=C(C=CC=C2)CC1)O
Synonyms	98569-12-1, 2-(BOC-AMINO)-1,2,3,4-TETRAHYDRONAPHTHALENE-2-CARBOXYLIC ACID, 2-(TERT-BUTOXYCARBONYLAMINO)-1,2,3,4-TETRAHYDRONAPHTHALENE-2-CARBOXYLIC ACID, 2-[(tert-butoxy)carbonylamino]-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid, 2-((tert-butoxycarbonyl)amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid, 2-[(tert-Butoxycarbonyl)amino]-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid, AC1MBYAJ, 2-N-Boc-amino-tetrahydro-2-naphthoic acid, N-BOC-DL-2-AMINOTETRALIN-2-CARBOXYLIC ACID, SCHEMBL2813574, CTK3I7838, DTXSID90369779, DSDQZWPRZHNCIX-UHFFFAOYSA-N, BCP18026, ZX-AV000962, MFCD00800586, AKOS009158210, AB07286, MCULE-1431639795, 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-dihydro-1H-naphthalene-2-carboxylic Acid, AK209014, BBV-38207234, BP-13300, OR322472, ST059583, SY011520, AB0213848, TC-306839, Z6017, BOC-2-AMINOTETRALIN-2-CARBOXYLIC ACID, MFCD00800586 (95%), N-BOC-DL-2-Aminotetralin-2-carboxylic acid, 98%, I14-106594, 2-N-BOC-1,2,3,4-TETRAHYDRONAPHTHALENE-2-CARBOXYLIC ACID, 2-tert-butoxycarbonylamino-1,2,3,4-tetrahydro-naphthalene-2-carboxylic acid, 2-tert-Butoxycarbonylamino-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid, 2-tert.butoxycarbonylamino-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid, 2-[(tert-butoxycarbonyl)amino]-3,4-dihydro-1H-naphthalene-2-carboxylic acid, 2-[[(1,1-Dimethylethoxy)carbonyl]amino]-1,2,3,4-tetrahydro-2-naphthalenecarboxylic acid, 2-{[(tert-butoxy)carbonyl]amino}-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid, 2-Naphthalenecarboxylicacid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-1,2,3,4-tetrahydro-, 2-Naphthalenecarboxylicacid,2-[[(1,1-dimethylethoxy)carbonyl]amino]-1,2,3,4-tetrahydro-, 2-({[(1,1-Dimethylethyl)oxy]carbonyl}amino)-1,2,3,4-tetrahydro-2-naphthalenecarboxylic acid, C16H21NO4, CID2733177, 50714-69-7,

Complexity	415
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	291.147g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	291.347g/mol
Monoisotopic Mass	291.147g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P280-P302+P352-P305+P351+P338-P261
UN Code

Certificate of Analysis

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