AG003DRK

646-19-5 | Heptane-1,7-diamine

AG003DRK

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CAS Number	646-19-5
Catalog Number	AG003DRK(AGN-PC-0JL936)
Chemical Name	Heptane-1,7-diamine
EC Number	211-468-2
IUPAC Name	heptane-1,7-diamine
InChI	InChI=1S/C7H18N2/c8-6-4-2-1-3-5-7-9/h1-9H2
InChI Key	PWSKHLMYTZNYKO-UHFFFAOYSA-N
MDL Number	MFCD00008246
Molecular Formula	C7H18N2
Molecular Weight	130.2312
NSC Number	45777
SMILES	NCCCCCCCN
UNII	3011L9B20C
Synonyms	1,7-diaminoheptane, 1,7-heptadiamine, 1,7-Diaminoheptane, Heptane-1,7-diamine, 646-19-5, 1,7-Heptanediamine, Heptamethylenediamine, UNII-3011L9B20C, 1,7-Diaminoheptane, 98%, CHEMBL28242, H2N(CH2)7NH2, PWSKHLMYTZNYKO-UHFFFAOYSA-N, MFCD00008246, 3011L9B20C, heptan-1,7-diamin, 1,9-diazanonane, NSC45777, EINECS 211-468-2, NSC 45777, ACMC-1ATSG, 1,7-Heptamethylenediamine, AC1Q54FT, SCHEMBL36258, AC1L2C35, CTK2F4614, DTXSID60214848, STR02318, ZINC1677577, 1,7-Heptanediamine (8CI)(9CI), ANW-34919, BDBM50216787, NSC-45777, SBB058724, STL175683, AKOS003789317, MCULE-3408586405, NE23254, RTR-032748, TRA0059781, 1,7-Heptanediamine; Heptamethylenediamine, AJ-29496, SC-93904, AB1002175, DB-054698, ST2419406, TL8004602, TR-032748, D0094, FT-0607021, ST45159941, KS-00001284, I14-19438, C7H18N2, CID69533, AR-1J1513, C7-H18-N2, 6631-00-1,

Complexity	40.2
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	130.147g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	130.235g/mol
Monoisotopic Mass	130.147g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	52A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H314-H318
Precuationary statements	P280-P305+P351+P338-P310
Siginal words

Certificate of Analysis

Lot Number