Basic information
- Standard SMILES
Nc1cncnc1- InChIKey
FVLAYJRLBLHIPV-UHFFFAOYSA-N- Molecular formula
- C4H5N3
- Average molar mass
- 95.1 g/mol
- Monoisotopic mass
- 95.04834716
Overview
Pyrimidin-5-amine is an aminopyrimidine.
Names & identifiers
- Preferred name
- Pyrimidin-5-amine
- IUPAC
- pyrimidin-5-amine
- English name
- 5-Aminopyrimidine
- Molecular formula
- C4H5N3
- Molecular weight
- 95.1
Names & synonyms
pyrimidin-5-amineCHEBI:38619RefChem:870915640-485-15-Aminopyrimidine591-55-95-pyrimidinaminePYRIMIDIN-5-YLAMINEMFCD01529870DTXSID20322438CS-D0764AKOS009317679
Show more names
5-Aminopyrimidine >5-Aminopyrimidine?New5-Pyrimidinamine (9CI)5-AMINOPYRIMIDINE (MFCD5-AMINOPYRIMIDINE ISO 9001：2015 REACHPyrimidin-5-amine, 5-Amino-1,3-diazine
PB12745SS-6051HY-60351A2589EN300-139664pyrimidine-5-amine5-Amino-pyrimidineBCP27570
Database identifiers
- CAS
591-55-9- PubChem CID
- 344373
- DTXSID
DTXSID20322438- ChEBI
CHEBI:38619- EC Number
- 640-485-1
- Nikkaji
- J79.681F
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 48.9
Physicochemical properties
- Melting point
- 171 °C · 171°C(lit.)
- Boiling point
- 240.7 · 240.7±13.0 °C(Predicted)
- Density
- 1.216 · 1.216±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- powder to crystal
- pka
- 2 · 2+-.0.10(Predicted)
- color
- White to Light yellow
- λmax
- 315 nm · 315nm(EtOH)(lit.)
- InChI
- InChI=1S/C4H5N3/c5-4-1-6-3-7-2-4/h1-3H,5H2
- InChIKey
- FVLAYJRLBLHIPV-UHFFFAOYSA-N
- SMILES
- C1=NC=C(N)C=N1
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- Hazard Codes
- Xi,Xn
- Risk Statements
- 22 · 22-36/37/38
- Safety Statements
- 26 · 26
- WGK Germany
- 3 · 3
- HazardClass
- IRRITANT-HARMFUL
- HS Code
- 2933599590 · 2933599590
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (97.8%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 45 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (97.8%)
Safety data
- wgk
- 3
- hs_code
- 2933599590
- risk_code
- 22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- safety_code
- 26
- hazard_class
- IRRITANT-HARMFUL
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H302-H315-H319-H335
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses5-Aminopyrimidine is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers50 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
泰州维生生物科技有限公司18351140886; 18351140886 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
南京德豪斯医药科技有限公司025-52161033 15312098939 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
南部县诚信科技有限公司0838-5675166 15883665058 · [email protected]
太原市瑞和丰科贸有限公司+86 351 7031519 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海恩诺生物科技有限公司+86 (21) 6435-5022
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海相辉医药科技有限公司13761987713 · [email protected]
武汉泰易成生化药业有限公司027-88320699 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
上海忆嵘生物科技有限公司18049974220 · [email protected]
杭州东帆化学有限公司86-0571-85151182
南京斯贝源医药科技有限公司+86-25-68710855, +86-25-68710897 · [email protected]
斯芬克司药物研发（天津）股份有限公司022-66211289-843 13672102692 · [email protected]
武汉海正工贸发展有限公司027-8866 0053/88660577/88660578
苏州岚云医药科技有限公司2332782371 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
上海仁曲医药科技有限公司18171398856 2968382473 · [email protected]
常州凯立医药科技有限公司0519-81096292 15312577869 · [email protected]
Shanghai Witofly Chemical Co.,Ltd[email protected]
苏州信一药谷生物科技有限公司0512-65757861-8000 · [email protected]
杭州迈世腾药物科技有限公司0571-82896630 18969958410 · [email protected]
KARMEL TECHNOLOGY (HK) CO.,LIMITED+8618795957998 · [email protected]
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]
上海将来实业股份有限公司021-61552785 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
平和安康医药科技有限公司18086832706 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
上海卓因生物科技有限公司021-61317773 · [email protected]
上海肯恩化学科技有限公司13120367189;18621755571 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
Additional notes
DefinitionChEBI: Pyrimidin-5-amine is an aminopyrimidine.
Related reactions
54 records
Linked notes
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