AG002W1E

2867-59-6 | 1-Butanol, 3-amino-

AG002W1E

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CAS Number	2867-59-6
Catalog Number	AG002W1E(AGN-PC-0MVCEZ)
Chemical Name	1-Butanol, 3-amino-
IUPAC Name	3-aminobutan-1-ol
InChI	InChI=1S/C4H11NO/c1-4(5)2-3-6/h4,6H,2-3,5H2,1H3
InChI Key	AGMZSYQMSHMXLT-UHFFFAOYSA-N
MDL Number	MFCD03412694
Molecular Formula	C4H11NO
Molecular Weight	89.1362
SMILES	CC(N)CCO
Synonyms	3-aminobutan-1-ol, 2867-59-6, 3-Amino-1-butanol, 3-Amino-butan-1-ol, 1-Butanol, 3-amino-, MFCD03412694, 1-Butanol,3-amino-, (3S)-, 3-aminobutanol, zlchem 642, 3-azanylbutan-1-ol, 1-Butanol,3-amino-, R-3-amino-1-butanol, 2-Amino-4-hydroxybutane, 3-amino-3-methylpropanol, 3-amino-3-methylpropan-1-ol, CTK4G1875, DTXSID80480280, ZLD0092, AGMZSYQMSHMXLT-UHFFFAOYSA-N, ACT06024, ALBB-010691, ANW-74100, STL453742, AKOS000321548, AKOS016042171, ACN-034818, AM84886, CM14429, CS-W004841, LS41893, MCULE-7239872808, QC-3162, TRA0067237, TRA0068740, VC30335, AK-41725, AK-41726, AK-81869, SC-82589, SY030187, AB0095435, AB1009062, DB-006344, TC-030262, 4CH-000671, 4CH-000675, 4CH-003013, A5415, BB 0259411, FT-0080080, FT-0602719, ST24041774, Z2685, EN300-82225, MFCD03412694 (95%), A57331, Y-0360, 867A596, A819531, S05-0119, Z1250132821, 3-Amino-butan-1-ol; (DL)-3-Amino-1-butanol; (DL)-3-Aminobutan-1-ol; R-3-Aminobutan-1-ol; 1-Butanol, 3-amino-, (R)-3-aminobutan-1-ol, (S)-3-Aminobutan-1-ol, (3S)-3-aminobutan-1-ol, C4H11NO, (R)-3-AMINO-1-BUTANOL, (S)-3-AMINO-1-BUTANOL, RW1699, C2785, 61477-39-2, 61477-40-5,

Complexity	30.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	89.084g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	89.138g/mol
Monoisotopic Mass	89.084g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H227-H315-H319-H335
Packing Group	Ⅱ
Precautionary statements	P305+P351+P338
UN Code	UN 2735

Certificate of Analysis

Lot Number