Basic information
- CAS
32343-73-0- Standard SMILES
CC(=O)NCCCCCN- InChIKey
RMOIHHAKNOFHOE-UHFFFAOYSA-N- Molecular formula
- C7H16N2O
- Average molar mass
- 144.21 g/mol
- Monoisotopic mass
- 144.12626313
Overview
N-acetylcadaverine is an N-substituted cadaverine that is cadaverine in which one of the amino groups has been converted to the corresponding acetamide. It has a role as a human metabolite. It is a secondary carboxamide, a member of acetamides, a N-substituted cadaverine and a primary amino compound. It is functionally related to a cadaverine. It is a conjugate base of a N-acetylcadaverine(1+).
Names & identifiers
- Preferred name
- N-Acetylcadaverine
- IUPAC
- N-(5-aminopentyl)acetamide
- English name
- monoacetylcadaverine
- Molecular formula
- C7H16N2O
- Molecular weight
- 144.21
Names & synonyms
n-(5-aminopentyl)acetamideN-AcetylcadaverineacetylcadaverineMonoacetyl cadaverineCHEBI:88824RefChem:828903691-456-532343-73-0MonoacetylcadaverineMFCD19204554Acetamide, N-(5-aminopentyl)-N-Acetyl-1,5-pentanediamine
Show more names
N-(5-Aminopentyl)acetamide >N-(5-Aminopentyl)acetamideInhibitor,Endogenous Metabolite,N(5Aminopentyl)acetamide,N (5 Aminopentyl)acetamide,inhibit
N-Acetylcadaverine;N-(5-Aminopentyl)acetamide; Acetylcadaverine; Monoacetyl Cadaverine;SCHEMBL346746orb1221135orb1301983SCHEMBL15058005DTXSID30186068RMOIHHAKNOFHOE-UHFFFAOYSA-N
Database identifiers
- CAS
32343-73-0- PubChem CID
- 189087
- DTXSID
DTXSID30186068- ChEBI
CHEBI:88824- EC Number
- 691-456-5
- Nikkaji
- J810.711D
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 93.6
Experimental & physicochemical properties
Physical DescriptionSolid
Collision Cross Section132.9 Ų [M+H]+ [CCS Type: DT; Method: single field calibrated with Agilent tune mix (Agilent)]
Physicochemical properties
- Boiling point
- 110 °C/0.02mmHg · 110°C/0.02mmHg(lit.)
- Density
- 0.938 · 0.938±0.06 g/cm3(Predicted)
- refractive index
- 1.479 · 1.4790-1.4830
- storage temp.
- -20 °C · -20°C
- solubility
- Chloroform (Slightly), Dichloromethane (Slightly)
- pka
- 16.48 · 16.48±0.46(Predicted)
- form
- clear liquid
- color
- Colorless to Light yellow to Light orange
- CAS DataBase Reference
- 32343 · 32343-73-0
- Symbol(GHS)
- 5 · GHS05
- Signal word
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
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1C (100%)
Safety data
- ridadr
- 2735
- hs_code
- 2924.19.1150
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_class
- 8
- packing_group
- III
- Hazard statements
- H314
- Precautionary statements
- P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-P501
Chemistry & industry
Applications
UsesN-(5-Aminopentyl)acetamide is an acetylated polyamine, a promising biochemical marker for cancer and many other pathophysiological conditions.
Suppliers43 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
ChemeGen 中国18818260767 · [email protected]
Related reactions
1 records
Compound notes
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