AG003P99

6329-61-9 | Decahydroisoquinoline

AG003P99

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CAS Number	6329-61-9
Catalog Number	AG003P99(AGN-PC-0A2Z26)
Chemical Name	Decahydroisoquinoline
EC Number	228-702-4
IUPAC Name	1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline
InChI	InChI=1S/C9H17N/c1-2-4-9-7-10-6-5-8(9)3-1/h8-10H,1-7H2
InChI Key	NENLYAQPNATJSU-UHFFFAOYSA-N
MDL Number	MFCD00012096
Molecular Formula	C9H17N
Molecular Weight	139.2380
NSC Number	43479
SMILES	C12C(CCCC2)CNCC1
Synonyms	Decahydroisoquinoline, 6329-61-9, Perhydroisoquinoline, Isoquinoline, decahydro-, NENLYAQPNATJSU-UHFFFAOYSA-N, decahydroisochinolin, trans-Decahydroisoquinoline, NSC43479, EINECS 228-702-4, decahydroiso-quinoline, Perhydroisoquinoline,c&t, AC1L3ZAX, AC1Q1HMY, ACMC-1CG6O, ACMC-2097bt, Perhydroisoquinoline, 96%, AC1Q4YF6, SCHEMBL14772, 3-azabicyclo[4.4.0]decane, 2744-09-4, KS-000015XX, ANW-75342, MFCD00012096, NSC-43479, AKOS009031130, MCULE-6456041823, AK-88774, TS-01817, DB-054452, Decahydroisoquiline(cis-and trans-mixture);, TL8004409, AM20070504, D2584, D5067, FT-0624481, FT-0694933, ST24030296, ST51036727, A25064, Decahydroisoquinoline (cis- and trans- mixture), 45912-EP2280003A2, 45912-EP2311807A1, 54074-EP2281818A1, 54074-EP2308510A1, 54074-EP2308562A2, 54074-EP2371811A2, 1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline, 329I619, I08-0158, I14-6327, Decahydroisoquinoline(cis-andtrans-mixture,predominantlycis-isomer), Decahydroisoquinoline (cis- and trans- mixture, predominantly cis-isomer), ISOQUINOLINE, C9H17N, C9-H17-N, CID97812, AR-1I3506, 64038-55-7,

Complexity	111
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	139.136g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	139.242g/mol
Monoisotopic Mass	139.136g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number