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4,9-Diazadodecamethylenediamine bis(phosphate)

HCID 77503
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3891-79-0
Standard SMILES
NCCC[NH2+]CCCC[NH2+]CCCN.O=P([O-])(O)O.O=P([O-])(O)O
InChIKey
GOQWEECJRRZEHR-UHFFFAOYSA-N
Molecular formula
C10H32N4O8P2
Average molar mass
398.33 g/mol
Monoisotopic mass
398.16953799

Overview

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Names & identifiers

Preferred name
4,9-Diazadodecamethylenediamine bis(phosphate)
IUPAC
3-aminopropyl-[4-(3-aminopropylazaniumyl)butyl]azanium;bis(dihydrogen phosphate)
English name
SPERMINE PHOSPHATE
Molecular formula
C10H32N4O8P2
Molecular weight
398.33

Names & synonyms

4,9-Diazadodecamethylenediamine bis(phosphate)3-aminopropyl-[4-(3-aminopropylazaniumyl)butyl]azanium;dihydrogen phosphateAKOS025295275SPERMINE PHOSPHATENEURIDINE PHOSPHATEGERONTINE PHOSPHATESPERMINE DIPHOSPHATEMUSCULAMINE PHOSPHATESPERMINE DIPHOSPHATE SALTDIAMINOPROPYLTETRAMETHYLENEDIAMINE PHOSPHATEN,N-(3-AMINOPROPYL)-1,4-BUTANEDIAMINE DIPHOSPHATEN,N'-BIS(3-AMINOPROPYL)-1,4-BUTANEDIAMINE PHOSPHATE

Database identifiers

CAS
3891-79-0
PubChem CID
77503

Properties

Computed structural properties

Topological polar surface area
246 Ų
Hydrogen bond donors
8
Hydrogen bond acceptors
10
Rotatable bonds
11
Heavy atoms
24
Formal charge
0
Complexity
136

Physicochemical properties

storage temp.
20 °C · −20°C
Merck
8743 · 8743
EPA Substance Registry System
1 · 1,4-Butanediamine, N,N'-bis(3-aminopropyl)-, phosphate (1:2) (3891-79-0)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3
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.

Safety data

wgk
3
tsca
TSCA listed
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
Hazard statements
H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Suppliers3 total

上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]

Related reactions

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Compound notes

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