AG002P3K

2470-68-0 | 1-Heptanamine, N-heptyl-

AG002P3K

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CAS Number	2470-68-0
Catalog Number	AG002P3K(AGN-PC-0JLPGC)
Chemical Name	1-Heptanamine, N-heptyl-
IUPAC Name	N-heptylheptan-1-amine
InChI	InChI=1S/C14H31N/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h15H,3-14H2,1-2H3
InChI Key	NJWMENBYMFZACG-UHFFFAOYSA-N
MDL Number	MFCD00027309
Molecular Formula	C14H31N
Molecular Weight	213.4026
NSC Number	79264
SMILES	CCCCCCCNCCCCCCC
UNII	5E36MJ5OI8
Synonyms	Diheptylamine, 2470-68-0, Di-n-heptylamine, 1-Heptanamine, N-heptyl-, N-heptylheptan-1-amine, UNII-5E36MJ5OI8, 5E36MJ5OI8, C14H31N, NSC 79264, Diheptylamine (8CI), N,N-Diheptylamine #, AI3-16572, AC1Q2WCU, AC1Q4TYL, 1-Heptanamine,N-heptyl-, ACMC-1CEI1, AC1L2P2M, SCHEMBL36300, DTXSID8062444, CTK4F4198, NJWMENBYMFZACG-UHFFFAOYSA-N, ALBB-014119, BB_SC-06765, NSC79264, ZINC1724011, ZX-AN012860, 8285AD, ANW-25514, BBL009739, MFCD00027309, NSC-79264, SBB059808, STL145786, AKOS005174422, MCULE-8281252980, NCGC00341246-01, CC-27056, TC-114259, D2675, FT-0634305, R1573, ST51046078, EN300-40587, AB00982877-01, AB00982877-03, C-11268, I05-1243, CID75580, AR-1I5222, C14-H31-N, 25384-67-2,

Complexity	89.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.246g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	213.409g/mol
Monoisotopic Mass	213.246g/mol
Rotatable Bond Count	12
Topological Polar Surface Area	12A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P501-P264-P280-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P405
Signal Words	danger
UN Code	UN 2735

Certificate of Analysis

Lot Number