AG002I5B

18925-44-5 | 1-Pentanamine, 4,4-dimethyl-

AG002I5B

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CAS Number	18925-44-5
Catalog Number	AG002I5B(AGN-PC-001GWM)
Chemical Name	1-Pentanamine, 4,4-dimethyl-
IUPAC Name	4,4-dimethylpentan-1-amine
InChI	InChI=1S/C7H17N/c1-7(2,3)5-4-6-8/h4-6,8H2,1-3H3
InChI Key	MJOCCSXOVAVKFC-UHFFFAOYSA-N
MDL Number	MFCD08449513
Molecular Formula	C7H17N
Molecular Weight	115.2166
SMILES	CC(C)(C)CCCN
Synonyms	4,4-dimethylpentan-1-amine, 18925-44-5, 1-Pentanamine, 4,4-dimethyl-, (4,4-DIMETHYLPENTYL)AMINE, 4,4-dimethylpentylamine, AC1Q1MIM, SCHEMBL74489, 4,4-Dimethyl-1-pentanamine, 4,4-dimethyl-pentan-1-amine, CTK0A3135, DTXSID60560534, MJOCCSXOVAVKFC-UHFFFAOYSA-N, MFCD08449513, ZINC19673381, AKOS010742630, MCULE-4819398612, AJ-74160, BS-12916, DA-08825, BB 0263040, FT-0737056, EN300-69724, Y-3892, Z1973465731,

Complexity	51.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	115.136g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	115.22g/mol
Monoisotopic Mass	115.136g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3(8)
Hazard statements	H226-H335-H314
Packing Group	Ⅲ
Precautionary statements	P210-P240-P241-P242-P243-P260-P264-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P370+P378-P403+P233-P403+P235-P405-P501
UN Code	UN 2733

Certificate of Analysis

Lot Number