Basic information
- CAS
35622-27-6- Standard SMILES
NCCCCP(=O)(O)O- InChIKey
IDPXFPYGZRMMKZ-UHFFFAOYSA-N- Molecular formula
- C4H12NO3P
- Average molar mass
- 153.12 g/mol
- Monoisotopic mass
- 153.05547987
Names & identifiers
- Preferred name
- 4-Aminobutylphosphonic acid
- IUPAC
- 4-aminobutylphosphonic acid
- English name
- 4-Aminobutylphosphonic acid
- Molecular formula
- C4H12NO3P
- Molecular weight
- 153.12
Names & synonyms
4-Aminobutylphosphonic acid35622-27-64-AbpaDTXSID80189100RefChem:518208DTXCID70111591(4-aminobutyl)phosphonic acidPhosphonic acid, (4-aminobutyl)-MFCD00063426(4-aminobutyl)phosphonicacidSCHEMBL745120butylphosphonic acid, 4-amino-
Show more names
SKL072(4-Aminobutyl)4-Aminobutyl-phosphonate4-aminobutylphosphonicaci4-aminobutanephosphonic acid4-Aminobutylphosphonic acid >=99%Phosphonic acid,P-(4-aMinobutyl)-4-AMINOBUTYLPHOSPHONIC ACID USP/EP/BP
orb3145383SCHEMBL3088086P-(4-aminobutyl)-phosphonic acidKBA62227Phosphonic acid, P-(4-aminobutyl)-TYD-047404-Aminobutylphosphonic acid, >=99%AKOS006275142
Database identifiers
- CAS
35622-27-6- PubChem CID
- 1726
- DTXSID
DTXSID80189100- EC Number
- 621-216-7
- Nikkaji
- J379.159I
Properties
Computed structural properties
- XLogP
- -4.1
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- Melting point
- 133 · 133-134 °C
- Boiling point
- 344.2 · 344.2±44.0 °C(Predicted)
- Density
- 1.304 · 1.304±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- Solid
- pka
- 1 · pK1: 2.55;pK2: 7.55;pK3: 10.9 (25°C)
- color
- White to gray
- Major Application
- detection
- InChI
- 1S/C4H12NO3P/c5-3-1-2-4-9(6,7)8/h1-5H2,(H2,6,7,8)
- InChIKey
- IDPXFPYGZRMMKZ-UHFFFAOYSA-N
- SMILES
- NCCCCP(O)(O)=O
- UNSPSC Code
- 12352106 · 12352106
- NACRES
- 26 · NA.26
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- RIDADR
- 3261 · 3261
- WGK Germany
- 3 · 3
- HazardClass
- 8 · 8
- PackingGroup
- III
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- ridadr
- 3261
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- hazard_class
- 8
- Storage Class
- 11 - Combustible Solids
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Usesdetection
Suppliers43 total
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
天津永生生物技术有限公司022-60987737 13512258274;13820956092 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
成都诺维尔生物医药有限公司028-85255396 18302801538 · [email protected]
上海尊理加生命科技有限公司021-34045219 13062664914 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
上海丝帆医药科技有限公司18916696128 · [email protected]
上海珂华生物科技有限公司021-58581007 18019463053 · [email protected]
河南威梯希化工科技有限公司0371-63284658 18135795563 · [email protected]
浙江联硕生物科技有限公司18616526224 · [email protected]
Aladdin Scientific[email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海鹿盟科技有限公司18049902746 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
上海锐谱医药科技有限公司15895968936 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
Golden Pharma Co., Limited+86-18958062155 · [email protected]
Related reactions
1 records
Compound notes
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