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1-Propanol, 3-((3-(boronooxy)propyl)amino)-

HCID 106038
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Basic information

CAS
67905-33-3
Standard SMILES
OCCCNCCCOB(O)O
InChIKey
MHESBQZGKGCYJF-UHFFFAOYSA-N
Molecular formula
C6H16BNO4
Average molar mass
177.01 g/mol
Monoisotopic mass
177.1172382

Names & identifiers

Preferred name
1-Propanol, 3-((3-(boronooxy)propyl)amino)-
IUPAC
3-(3-hydroxypropylamino)propoxyboronic acid
English name
3-[[3-[(dihydroxyboryl)oxy]propyl]amino]propan-1-ol
Molecular formula
C6H16BNO4
Molecular weight
177.01

Names & synonyms

Diisopropanolamine borate1-Propanol, 3-((3-(boronooxy)propyl)amino)-EINECS 267-652-81-Propanol, 3-[[3-(boronooxy)propyl]amino]-DTXSID10708023-[[3-[(Dihydroxyboryl)oxy]propyl]amino]propan-1-ol3-((3-((Dihydroxyboryl)oxy)propyl)amino)propan-1-olRefChem:436256DTXCID2045230267-652-867905-33-3MHESBQZGKGCYJF-UHFFFAOYSA-N
Show more names
3-[[3-[(Dihydroxyboryl)oxy]propyl]amino]-1-propanol
NS000871333-[(3-Hydroxypropyl)amino]propyl dihydrogen borate

Database identifiers

CAS
67905-33-3
PubChem CID
106038
DTXSID
DTXSID1070802
EC Number
267-652-8
Nikkaji
J287.682E

Properties

Computed structural properties

Topological polar surface area
82 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
12
Formal charge
0
Complexity
93.6

Experimental & physicochemical properties

Physical DescriptionLiquid

Physicochemical properties

EPA Substance Registry System
1 · 1-Propanol, 3-[[3-(boronooxy)propyl]amino]- (67905-33-3)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 1 item

1-Propanol, 3-[[3-(boronooxy)propyl]amino]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanol, 3-[[3-(boronooxy)propyl]amino]- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Hazard Classes and CategoriesEye Irrit. 2 (50%)

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P

Chemistry & industry

Uses & manufacturing

U.S. Production2023: 44,918 lb
Consumer UsesLubricating agent
Industry UsesLubricating agent
General Manufacturing Information · 2 items

Petroleum Lubricating Oil and Grease Manufacturing

1-Propanol, 3-[[3-(boronooxy)propyl]amino]-: ACTIVE

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Compound notes

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