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1-Piperazinebutanol,3-methyl-(CAS No. 5472-83-3) CAS NO.5472-83-3
- Min.Order: 1 Gram
- Payment Terms: L/C,T/T,
- Product Details
Keywords
- 1-Piperazinebutanol,3-methyl-
- 1-Piperazinebutanol,3-methyl-(CAS No. 5472-83-3)
- 5472-83-3
Quick Details
- ProName: 1-Piperazinebutanol,3-methyl-(CAS No. ...
- CasNo: 5472-83-3
- Molecular Formula: C9H20 N2 O
- Appearance: Solid
- Application: Organic Chemicals
- DeliveryTime: according to client's demand quantity
- PackAge: as requested
- Port: SHANGHAI
- ProductionCapacity: 100 Kilogram/Month
- Purity: 99%
- Storage: room temperature
- Transportation: as requested
- LimitNum: 1 Gram
- Grade: Industrial Grade
Superiority
Details
Identification and Related Records
【Name】
1-Piperazinebutanol,3-methyl-
【CAS Registry number】
5472-83-3
【Synonyms】
NSC 29524
【Molecular Formula】
C9H20 N2 O (Products with the same molecular formula)
【Molecular Weight】
0
【Inchi】
InChI=1/C9H20N2O/c1-9-8-11(6-4-10-9)5-2-3-7-12/h9-10,12H,2-8H2,1H3
【Canonical SMILES】
CC1CN(CCN1)CCCCO
【MOL File】
5472-83-3.mol
Chemical and Physical Properties
【Density】
0.948g/cm3
【Boiling Point】
281.3°C at 760 mmHg
【Refractive Index】
1.464
【Flash Point】
123.9°C
【Computed Properties】
Molecular Weight:172.2679 [g/mol]
Molecular Formula:C9H20N2O
XLogP3-AA:0.1
H-Bond Donor:2
H-Bond Acceptor:3
Rotatable Bond Count:4
Exact Mass:172.157563
MonoIsotopic Mass:172.157563
Topological Polar Surface Area:35.5
Heavy Atom Count:12
Formal Charge:0
Complexity:119
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:2
Feature 3D Cation Count:2
Feature 3D Ring Count:1
Effective Rotor Count:5.2
Conformer Sampling RMSD:0.6
CID Conformer Count:105